Use device 0 as 0th gpu Startfile from command line: start.olestra.blyp *********************************************************** * TeraChem v1.99-Dev * * Hg Version: a4fef561d31d * * Development Version * * Compiled without textures * * Chemistry at the Speed of Graphics! * *********************************************************** * This program may only be used in connection with * * a valid license from PetaChem, LLC. Use of this program * * or results thereof indicates acceptance of all terms * * and conditions stated in the license and that a valid * * license agreement between the user and PetaChem, LLC * * exists. PetaChem, LLC does not warrant the correctness * * of results or their suitability for any purpose. * * Please email bugs, suggestions, and comments to * * help@petachem.com * * * *********************************************************** *********************************************************** * Compiled by toddmtz Mon Sep 4 09:23:32 PDT 2017 * * Supported architectures: sm_20 sm_30 sm_50 sm_60 * * Cuda compilation tools, release 8.0, V8.0.44 * *********************************************************** Job started Mon Sep 4 16:24:13 2017 On fire-14-00 (available memory: 597795 MB) ######################################### RUNTIME INFO ########################################## /home/toddmtz/production.latest/build/bin/terachem -g0 start.olestra.blyp NVRM version: NVIDIA UNIX x86_64 Kernel Module 384.27 Sun May 21 00:39:55 PDT 2017 GCC version: gcc version 4.8.5 20150623 (Red Hat 4.8.5-11) (GCC) linux-vdso.so.1 => (0x00007fff191c2000) libcurl.so.4 => /usr/lib64/libcurl.so.4 (0x00007fa1b696d000) libintbox.so.1 => /home/toddmtz/production.latest/build/lib/libintbox.so.1 (0x00007fa196a1c000) libthcbox.so.1 => /home/toddmtz/production.latest/build/lib/libthcbox.so.1 (0x00007fa194ddd000) libgridbox.so.1 => /home/toddmtz/production.latest/build/lib/libgridbox.so.1 (0x00007fa1948ef000) libdftbox.so.1 => /home/toddmtz/production.latest/build/lib/libdftbox.so.1 (0x00007fa1945d9000) libcuda.so.1 => /usr/lib64/libcuda.so.1 (0x00007fa1937be000) libcudart.so.8.0 => /home/toddmtz/production.latest/build/lib/libcudart.so.8.0 (0x00007fa193558000) libcublas.so.8.0 => /home/toddmtz/production.latest/build/lib/libcublas.so.8.0 (0x00007fa190ba7000) libcufft.so.8.0 => /home/toddmtz/production.latest/build/lib/libcufft.so.8.0 (0x00007fa187d59000) libcrypto.so.10 => /usr/lib64/libcrypto.so.10 (0x00007fa18796f000) libssl.so.10 => /usr/lib64/libssl.so.10 (0x00007fa187700000) libm.so.6 => /usr/lib64/libm.so.6 (0x00007fa1873fe000) libcilkrts.so.5 => /home/toddmtz/production.latest/build/lib/libcilkrts.so.5 (0x00007fa1871bd000) libstdc++.so.6 => /usr/lib64/libstdc++.so.6 (0x00007fa186eb3000) libgcc_s.so.1 => /usr/lib64/libgcc_s.so.1 (0x00007fa186c9d000) libpthread.so.0 => /usr/lib64/libpthread.so.0 (0x00007fa186a81000) libdl.so.2 => /usr/lib64/libdl.so.2 (0x00007fa18687c000) libc.so.6 => /usr/lib64/libc.so.6 (0x00007fa1864bb000) /lib64/ld-linux-x86-64.so.2 (0x00007fa1b6be8000) libidn.so.11 => /usr/lib64/libidn.so.11 (0x00007fa186288000) libssh2.so.1 => /usr/lib64/libssh2.so.1 (0x00007fa18605d000) libssl3.so => /usr/lib64/libssl3.so (0x00007fa185e11000) libsmime3.so => /usr/lib64/libsmime3.so (0x00007fa185bea000) libnss3.so => /usr/lib64/libnss3.so (0x00007fa1858bf000) libnssutil3.so => /usr/lib64/libnssutil3.so (0x00007fa185692000) libplds4.so => /usr/lib64/libplds4.so (0x00007fa18548e000) libplc4.so => /usr/lib64/libplc4.so (0x00007fa185288000) libnspr4.so => /usr/lib64/libnspr4.so (0x00007fa18504a000) libgssapi_krb5.so.2 => /usr/lib64/libgssapi_krb5.so.2 (0x00007fa184dfc000) libkrb5.so.3 => /usr/lib64/libkrb5.so.3 (0x00007fa184b14000) libk5crypto.so.3 => /usr/lib64/libk5crypto.so.3 (0x00007fa1848e2000) libcom_err.so.2 => /usr/lib64/libcom_err.so.2 (0x00007fa1846de000) liblber-2.4.so.2 => /usr/lib64/liblber-2.4.so.2 (0x00007fa1844ce000) libldap-2.4.so.2 => /usr/lib64/libldap-2.4.so.2 (0x00007fa18427b000) libz.so.1 => /usr/lib64/libz.so.1 (0x00007fa184065000) librt.so.1 => /usr/lib64/librt.so.1 (0x00007fa183e5c000) libnvidia-fatbinaryloader.so.384.27 => /usr/lib64/libnvidia-fatbinaryloader.so.384.27 (0x00007fa183c0a000) libkrb5support.so.0 => /usr/lib64/libkrb5support.so.0 (0x00007fa1839fa000) libkeyutils.so.1 => /usr/lib64/libkeyutils.so.1 (0x00007fa1837f6000) libresolv.so.2 => /usr/lib64/libresolv.so.2 (0x00007fa1835db000) libsasl2.so.3 => /usr/lib64/libsasl2.so.3 (0x00007fa1833be000) libselinux.so.1 => /usr/lib64/libselinux.so.1 (0x00007fa183196000) libcrypt.so.1 => /usr/lib64/libcrypt.so.1 (0x00007fa182f5f000) libpcre.so.1 => /usr/lib64/libpcre.so.1 (0x00007fa182cfe000) libfreebl3.so => /usr/lib64/libfreebl3.so (0x00007fa182afa000) ################################################################################################# Cannot find license.dat file in the TeraChem installation directory /home/toddmtz/production.latest/build TRYING THE NETWORK LICENSE... Connecting to license server '54.208.252.40' port '8877'... Connected! Checking your license... ************************************************************** Greetings, Martinez Group! You have 1000 licenses in total IN USE: 37 AVAILABLE: 963 ************************************************************** Scratch directory: ./scr Random number seed: 1779737769 XYZ coordinates olestra.xyz Molden File Output: ./scr/olestra.molden Using basis set: 6-31gs Spin multiplicity: 1 DIIS will use up to 10 vectors. WF convergence threshold: 3.00e-05 Using DIIS algorithm to converge WF Maximum number of SCF iterations: 100 Incremental fock with rebuild every 8 iterations Will switch to conventional Fock if diffuse functions are detected X-matrix tolerance: 1.00e-04 PRECISION: DYNAMIC DFT Functional requested: blyp Method: BLYP Becke 1988 exchange functional: 1.0 Lee-Yang-Parr correlation functional: 1.0 Wavefunction: RESTRICTED DFT grid type: 1 Using dynamic DFT grids. Initial guess generated by maximum overlap ******************************************** **** SINGLE POINT GRADIENT CALCULATIONS **** ******************************************** SCF: Initial guess is taken from previous step using 1 out of 10 CUDA devices Device 0: GeForce GTX 1080 Ti, 11172MB, CC 6.1 -- CPU THREAD 0 Device 1: GeForce GTX 1080 Ti, 11172MB, CC 6.1 -- IDLE Device 2: GeForce GTX 1080 Ti, 11172MB, CC 6.1 -- IDLE Device 3: GeForce GTX 1080 Ti, 11172MB, CC 6.1 -- IDLE Device 4: GeForce GTX 1080 Ti, 11172MB, CC 6.1 -- IDLE Device 5: GeForce GTX 1080 Ti, 11172MB, CC 6.1 -- IDLE Device 6: GeForce GTX 1080 Ti, 11172MB, CC 6.1 -- IDLE Device 7: GeForce GTX 1080 Ti, 11172MB, CC 6.1 -- IDLE Device 8: GeForce GTX 1080 Ti, 11172MB, CC 6.1 -- IDLE Device 9: GeForce GTX 1080 Ti, 11172MB, CC 6.1 -- IDLE ------------------------------------------------------------------- Compiled with MAGMA support. MAGMA parameters: Matrices larger than 1000 square will be treated with MAGMA (Change by setting the MagmaMinN environment variable) Magma will use 1 out of 1 GPUs (Change by setting the MagmaNGPUs environment variable) ------------------------------------------------------------------- CPU Memory Available: 96717.88 MegaWords GPU Memory Available: 1140.55 MegaWords Maximum recommended basis set size: 12200 basis functions (limited by GPU memory) ------------------------------------------------------------------- Using d-functions. Configuring GPUs accordingly. 0: CUBLAS initialized, available GPU memory: 8266MB Basis set: 6-31gs Total atoms: 453 Total charge: 0 Total electrons: 1366 (683-alpha, 683-beta) Number electrons modeled by ECPs: 0 Total orbitals: 3181 Total AO shells: 1606 (1081 S-shells; 350 P-shells; 175 D-shells; 0 F-shells; 0 G-shells) Spin multiplicity: 1 Nuclear repulsion energy (QM atoms): 41609.128718464613 a.u. Guess time: 1.762 Setting up the DFT grid... time to set the grid = 1.81 s DFT grid points: 422241 (932 points/atom) Setting up the DFT grid... time to set the grid = 4.76 s DFT grid points: 1178034 (2600 points/atom) *** Start SCF Iterations *** Iter DIIS Error Energy change Electrons XC Energy J K LA DFT Energy Time(s) ------------------------------------------------------------------------------------------------------------------------------- >>> Purifying P... IDMP = 3.66e-14 <<< THRESPDP set to 1.00e+00 >>> SWITCHING TO GRID 1 <<< 1 0.3820763017 -7485.1035095554 1366.0174791449 -1059.8747868599 1.91 0.00 3.91 3.06 -7485.1035095554 10.78 >>> SWITCHING TO GRID 0 <<< 2 0.3605890485 +26.0603129736 1365.9782118597 -1155.6538289218 2.00 0.00 3.93 1.62 -7459.0431965818 7.58 3 0.4090528727 +64.2030243840 1366.0027138169 -1115.4067463409 2.00 0.00 3.97 1.52 -7394.8401721978 7.53 4 0.4366190617 +25.9417390628 1366.0563960345 -1120.0175249271 1.95 0.00 3.99 1.54 -7368.8984331350 7.51 5 0.1691113440 -161.5069197162 1366.0132647368 -1113.7849332877 1.90 0.00 4.05 1.66 -7530.4053528512 7.64 6 0.2966859222 +46.8503477057 1366.0279469360 -1109.1207337860 1.85 0.00 4.21 1.53 -7483.5550051455 7.65 7 0.3694349187 -20.6257279014 1366.0245989600 -1104.3145447540 1.75 0.00 4.12 1.55 -7504.1807330469 7.45 8 0.0839659626 -30.1579522740 1366.0182859630 -1108.9546730369 1.72 0.00 4.12 1.52 -7534.3386853209 7.39 THRESPDP set to 1.02e-04 9 0.2149533192 +12.1423340395 1366.0172892332 -1109.3042864802 3.17 0.00 4.15 2.68 -7522.1963512814 10.09 10 0.0550281044 -13.9695247255 1366.0168217760 -1109.5211889941 1.90 0.00 4.19 2.68 -7536.1658760068 8.80 11 0.0216868716 -0.5392386886 1366.0180571440 -1109.4203784552 1.76 0.00 4.17 2.75 -7536.7051146954 8.71 12 0.0113224219 -0.0504718109 1366.0179401055 -1109.2019585136 1.70 0.00 4.18 2.70 -7536.7555865063 8.61 13 0.0075657107 -0.0379871411 1366.0175558313 -1109.4504896672 1.65 0.00 4.29 2.74 -7536.7935736474 8.72 >>> SWITCHING TO GRID 1 <<< 14 0.0050793530 -0.0155968049 1366.0057921937 -1109.2722674986 1.63 0.00 4.16 5.68 -7536.8091704523 11.50 15 0.0032914466 -0.0023763883 1366.0058038065 -1109.2639837625 1.41 0.00 4.15 5.55 -7536.8115468405 11.14 16 0.0033076138 -0.0008860060 1366.0058037506 -1109.2967540061 1.35 0.00 4.18 5.57 -7536.8124328465 11.13 17 0.0021521689 -0.0003324475 1366.0058052012 -1109.3214970528 3.17 0.00 4.21 5.69 -7536.8127652940 13.16 18 0.0010054608 -0.0002634113 1366.0058105571 -1109.3132174906 1.36 0.00 4.17 5.67 -7536.8130287054 11.23 19 0.0005460889 -0.0001337619 1366.0058136197 -1109.2999804143 1.22 0.00 4.17 5.67 -7536.8131624673 11.09 20 0.0002043389 -0.0000576979 1366.0058103722 -1109.3057859213 1.21 0.00 4.19 5.74 -7536.8132201652 11.17 21 0.0001597467 -0.0000094939 1366.0058091984 -1109.3064724489 1.12 0.00 4.30 5.76 -7536.8132296591 11.21 22 0.0001375397 -0.0000057961 1366.0058093547 -1109.3015801489 1.09 0.00 4.18 5.77 -7536.8132354552 11.06 23 0.0000557630 -0.0000031563 1366.0058092117 -1109.3024222850 1.00 0.00 4.15 5.69 -7536.8132386115 10.87 24 0.0000207267 -0.0000009475 1366.0058092392 -1109.3025356400 0.84 0.00 1.56 5.86 -7536.8132395589 8.29 ------------------------------------------------------------------------------------------------------------------------------- FINAL ENERGY: -7536.8132395589 a.u. CENTER OF MASS: {0.582359, -0.077189, -2.189489} ANGS DIPOLE MOMENT: {5.901983, -4.509319, -2.263782} (|D| = 7.764796) DEBYE Running Mulliken population analysis... Gradient: K elapsed time: 0.00 sec Gradient: 1E elapsed time: 0.29 sec Gradient: 1E(ECP) elapsed time: 0.00 sec Gradient: NUC elapsed time: 0.00 sec Gradient: CL elapsed time: 5.12 sec Gradient (XC): Time to pack points: 0.07 sec Gradient (XC): Time to compute density: 1.43 sec Gradient (XC): Time to compute functional: 0.24 sec Gradient (XC): Time to compute grid gradient: 10.74 sec Gradient (XC): Time to repack points: 0.20 sec GPU Memory: 8126 Mb Gradient (XC): Time to compute gradient: 8.53 sec Gradient: XC elapsed time: 21.21 sec Writing out molden info Gradient units are Hartree/Bohr --------------------------------------------------- dE/dX dE/dY dE/dZ 0.0285517751 0.0106335392 -0.0065389851 0.0010207545 -0.0036671996 0.0201829022 -0.0184194507 -0.0050542191 0.0126801682 0.0440417997 0.0500901541 0.0105060793 0.0135173563 -0.0030573846 0.0423905912 -0.0254279987 -0.0200735194 0.0370085147 -0.0101454689 -0.0497101337 0.0030076324 -0.0463846303 -0.0028378913 -0.0286808487 0.0057649912 0.0411953439 0.0003735652 0.0332493339 -0.0071677350 0.0262050967 -0.0299624905 0.0053696003 0.0398953292 0.0502375544 0.0798696591 -0.0422351205 -0.0620282365 -0.0170129597 0.0860531828 -0.0432087283 -0.0935849418 -0.0296004453 -0.0455185212 0.0447129751 -0.0845218045 -0.0741000004 0.0477890911 0.0556166770 0.0275490602 0.0963827612 -0.0347076804 0.0047918329 -0.0759457787 -0.0719443229 -0.0364302506 0.0329797433 -0.0907797716 -0.0132505981 -0.0024938012 0.0060040386 0.0109014918 0.0015206607 -0.0155791739 0.0075791960 0.0180404212 -0.0058174238 0.0245313770 -0.0088452308 -0.0028654100 0.0015014688 -0.0312577625 -0.0138544066 0.0070548885 0.0301580047 -0.0132270605 0.0099482071 0.0082106281 -0.0241658563 -0.0033923851 0.0049046586 0.0050384804 -0.0024709503 0.0155231672 -0.0073414538 0.0010489961 -0.0184675232 -0.0064796074 -0.0016503862 -0.0033945850 0.0051379961 0.0027120916 -0.0137946180 0.0256467004 -0.0073151103 -0.0620540524 0.0575423476 0.0065670937 -0.0206875746 0.0139936797 0.0038723898 0.0177467955 -0.0090245875 -0.0045195820 -0.0214279798 0.0134663502 0.0090800537 0.0230530142 -0.0129142450 -0.0092994107 -0.0246064956 0.0127181128 0.0089421706 0.0233519540 -0.0135871149 -0.0188380387 -0.0320050484 0.0127169906 0.0061672992 0.0114375334 -0.0046862902 0.0102172339 0.0087854010 -0.0007266726 -0.0305538022 -0.0258067950 0.0033721110 0.0222924383 0.0150078170 0.0026312594 -0.0249006807 -0.0156871821 -0.0014128777 0.0259793064 0.0128212029 0.0007926524 -0.0271198719 -0.0122083338 -0.0012094044 0.0279980363 0.0109378728 -0.0019890717 0.0511035194 -0.0108207501 -0.0702271581 0.0147600854 -0.0131399196 -0.0104807381 -0.0109869256 -0.0003790848 0.0170366361 0.0170407221 -0.0011543840 -0.0218845848 -0.0173326934 -0.0031648152 0.0215207097 0.0178550356 0.0034781187 -0.0238230757 -0.0180580896 -0.0035009002 0.0206169411 0.0215434333 0.0127856854 -0.0310089573 -0.0084733651 -0.0033151531 0.0103465331 -0.0053220156 -0.0090529517 0.0083371717 0.0176161485 0.0258703109 -0.0269738068 -0.0083062916 -0.0219946709 0.0171791413 0.0086625002 0.0233887143 -0.0175305816 -0.0032357651 -0.0188759501 0.0241656485 0.0071724004 0.0213430825 -0.0175154267 -0.0092605644 -0.0221831546 0.0180854660 0.0199231789 0.0820325985 0.0214508566 -0.0093460602 0.0207553339 -0.0067289668 -0.0093117577 -0.0176525334 -0.0027246522 0.0088824467 0.0245801118 0.0050409467 -0.0113717163 -0.0246706712 -0.0075795065 0.0130633553 0.0264306511 0.0070622069 -0.0120071358 -0.0247308587 -0.0081435887 0.0247813351 0.0300614441 0.0119566006 -0.0069678730 -0.0105549596 -0.0044550269 -0.0114248588 -0.0052976293 -0.0054890759 0.0320010764 0.0169257525 0.0163762911 -0.0263105079 -0.0077887294 -0.0103662880 0.0275491855 0.0075846586 0.0114019676 -0.0276738167 -0.0070612526 -0.0104329652 0.0266810041 0.0067949156 0.0090308915 -0.0273821929 -0.0090040969 -0.0095050446 0.0590466669 -0.0415572716 0.0499435977 0.0014150229 -0.0291818428 0.0018364061 -0.0070740182 0.0126376770 -0.0133533504 0.0123237741 -0.0157521432 0.0180617799 -0.0124742242 0.0131593295 -0.0215611680 0.0144702479 -0.0131404995 0.0236381959 -0.0145986705 0.0124077300 -0.0229306272 0.0158946292 -0.0102393044 0.0361834431 -0.0054877773 0.0052699702 -0.0109061508 -0.0018424997 -0.0030933806 -0.0141509055 0.0058821518 0.0033812994 0.0402029652 0.0005945909 -0.0053819130 -0.0280234533 0.0000591574 0.0067360737 0.0302626973 0.0002869147 -0.0061181347 -0.0293780902 -0.0002767288 0.0074649446 0.0290598285 -0.0014845590 -0.0056606479 -0.0309906279 0.0709133676 -0.0041821547 -0.0426370052 0.0210901133 0.0074694169 -0.0139983351 -0.0149363673 0.0047356644 0.0143905974 0.0202214641 -0.0039663461 -0.0174560093 -0.0200914158 0.0078246145 0.0188149736 0.0210673520 -0.0081916017 -0.0199074619 -0.0211768227 0.0078718565 0.0189067020 0.0251788375 -0.0185066165 -0.0264054141 -0.0083469179 0.0059114392 0.0089165021 -0.0046652839 0.0098862537 0.0083127681 0.0130690223 -0.0298510068 -0.0247659567 -0.0039995929 0.0245929381 0.0157169304 0.0048375767 -0.0252912440 -0.0158906375 -0.0048185380 0.0250596291 0.0164468276 0.0044278595 -0.0256085822 -0.0161182792 -0.0055433949 0.0247043911 0.0168187286 -0.0358145911 -0.0818121857 0.0107479132 -0.0222561725 -0.0268907585 -0.0113696623 0.0042114092 0.0164994164 -0.0014966529 -0.0114519811 -0.0260509996 0.0050728420 0.0056564680 0.0259497793 -0.0066849120 -0.0076199768 -0.0277840081 0.0074601938 0.0056129070 0.0265057718 -0.0050113682 -0.0038860806 -0.0384377857 0.0137725780 0.0022150592 0.0137530761 -0.0035731446 -0.0031923100 0.0112323757 -0.0081596518 0.0078032231 -0.0337830892 0.0210734788 -0.0100296538 0.0208964074 -0.0167535893 0.0090197374 -0.0212921744 0.0184343999 -0.0091692831 0.0213145075 -0.0185365234 0.0103725097 -0.0213928688 0.0180654583 -0.0101153451 0.0225663063 -0.0170653177 0.0125359065 0.0741562987 0.0370151619 0.0149851334 0.0185563976 0.0051691880 -0.0028699403 -0.0157891742 -0.0094683248 0.0021280845 0.0228195629 0.0104900789 -0.0003970930 -0.0232659372 -0.0152671935 -0.0009920077 0.0256736876 0.0143425052 0.0025924885 -0.0247353376 -0.0133923388 -0.0065012470 0.0309781234 0.0253083540 0.0025354385 -0.0102591065 -0.0087644402 0.0062980357 -0.0067571965 -0.0102978541 -0.0165414403 0.0189071627 0.0318329633 0.0143742097 -0.0080820809 -0.0224348168 -0.0135351793 0.0085480931 0.0250335354 0.0142583803 -0.0075816296 -0.0240587546 -0.0153668146 0.0076471449 0.0246652616 0.0147432765 -0.0089377411 -0.0235133093 0.0050437081 -0.0441726434 0.0631931327 -0.0020876584 -0.0214022899 0.0168048415 -0.0023416273 0.0103379201 -0.0199972435 0.0038023853 -0.0144193564 0.0226097251 -0.0065337004 0.0122685494 -0.0254412674 0.0057153622 -0.0127223982 0.0254651859 -0.0058863371 0.0125674906 -0.0238616011 0.0148716175 -0.0089820779 0.0362372913 -0.0039438772 0.0047031831 -0.0125172671 -0.0071112408 -0.0033257685 -0.0116425749 0.0204067670 0.0065932455 0.0357705433 -0.0153612905 -0.0097205391 -0.0219590002 0.0181505689 0.0095335899 0.0228132890 -0.0160027127 -0.0102750472 -0.0224902142 0.0152528380 0.0108212057 0.0214756620 -0.0167907280 -0.0084475591 -0.0231000630 0.0134978810 0.0120647862 0.0160091532 -0.0075293451 -0.0095961249 -0.0081683280 0.0025853573 0.0212654204 -0.0126042810 0.0003686776 -0.0136962748 0.0049849013 -0.0243708865 -0.0020698607 0.0001113985 0.0148768383 -0.0032323373 0.0014273090 -0.0041181216 0.0076478169 0.0237179748 0.0047963042 -0.0062129370 -0.0119219480 0.0244512089 0.0015665894 0.0079160227 -0.0139417864 0.0018168838 -0.0036302761 0.0116856075 -0.0139038353 0.0159661948 -0.0083453489 0.0061983518 -0.0099347104 -0.0003812123 -0.0226669423 -0.0111713717 0.0016816393 0.0135760258 0.0041019856 -0.0130640893 0.0013721727 0.0203219152 0.0089492486 0.0024467147 -0.0113969819 0.0055749367 -0.0040031646 0.0032371676 -0.0073893911 0.0043436251 -0.0018671434 0.0068386344 -0.0018964174 -0.0028868595 -0.0050612092 0.0067097421 0.0033996655 -0.0084115361 -0.0073079958 0.0040716445 -0.0002152663 -0.0031080013 0.0037382178 -0.0070738435 -0.0008965429 -0.0023105336 -0.0065103844 -0.0004183399 0.0003548463 0.0038401846 -0.0064591690 -0.0038134104 -0.0008979052 -0.0021216836 0.0038326403 0.0062942647 0.0016454033 -0.0016076190 -0.0025671098 0.0058258230 -0.0006847892 -0.0069696167 0.0041075126 0.0004337190 0.0024220497 -0.0007928994 -0.0055619677 0.0020418425 0.0101702995 0.0010432541 0.0056712330 0.0059862667 -0.0070156737 0.0007397956 -0.0079661005 0.0012450545 -0.0021599729 -0.0044128672 0.0058629633 -0.0011374807 0.0100115672 -0.0000819038 0.0044882011 0.0041178385 -0.0086431634 0.0003872537 -0.0093853802 -0.0001497568 -0.0051466891 -0.0037513487 0.0079509730 -0.0005387406 0.0101383065 0.0003145783 0.0050884697 0.0036494517 -0.0075164001 0.0000466362 -0.0094004219 -0.0000752668 -0.0054935941 -0.0036571610 0.0076525322 0.0002495954 0.0106929586 -0.0002253766 0.0053814641 0.0043279253 -0.0076977717 0.0020255170 -0.0036230656 0.0044354994 -0.0046308325 0.0004574184 -0.0035147143 0.0049495830 0.0081010992 0.0047313530 0.0106493628 0.0015099650 -0.0032953815 -0.0042395882 -0.0075765196 -0.0043273464 -0.0085725856 -0.0011035990 0.0029317333 0.0044153198 0.0078457877 0.0043057472 0.0099513076 0.0006246108 -0.0035600286 -0.0048163675 -0.0079551273 -0.0032826178 -0.0100616900 0.0004232825 0.0038544255 0.0050885543 0.0076088045 0.0029063177 0.0094765416 -0.0006598399 -0.0038614596 -0.0052751240 -0.0065548363 -0.0025065638 -0.0094122580 0.0022519327 0.0037598876 -0.0101503710 -0.0047062504 0.0034772424 -0.0007423448 -0.0000285065 0.0061512874 0.0062315348 -0.0000861626 -0.0030510871 0.0014174536 -0.0018592372 -0.0078306585 -0.0103840197 -0.0014117629 0.0029160168 -0.0002772969 0.0017148880 0.0107032055 0.0090675781 0.0016777504 -0.0028473732 0.0005129019 -0.0006326253 -0.0089946027 -0.0094742825 -0.0017668877 0.0027613447 -0.0003669409 0.0004177392 0.0100914181 0.0093222796 0.0019302992 -0.0027073475 0.0008736072 0.0000821757 -0.0087219448 -0.0087422469 -0.0014929616 0.0036554792 -0.0010023740 0.0000595387 0.0106842937 0.0042041442 -0.0037497573 -0.0024297435 -0.0021708909 0.0052788047 0.0000718125 -0.0067526971 -0.0086787612 0.0011847918 0.0012869243 -0.0055776331 0.0090384579 0.0061270676 0.0074246235 -0.0008904646 -0.0016561593 0.0047195695 -0.0084901281 -0.0063958308 -0.0077577469 0.0006204437 0.0018748123 -0.0048886889 0.0086677829 0.0010022919 0.0027993349 -0.0080234767 0.0005545722 0.0068214154 -0.0076115077 -0.0071745197 -0.0080048446 0.0009967385 0.0016929072 -0.0046550409 0.0081553654 0.0063315660 0.0079306362 -0.0007282432 -0.0020558824 0.0048135864 -0.0086486061 -0.0043545368 -0.0050925790 0.0029612271 -0.0040727327 -0.0077763175 -0.0064783164 0.0021306065 0.0074573420 -0.0031270539 0.0016236998 0.0064620249 0.0043766746 -0.0039536964 -0.0082014916 0.0039409707 -0.0017338398 -0.0066386696 -0.0068765378 0.0042567689 0.0073544160 -0.0031751845 0.0019430764 0.0065244666 0.0072287748 -0.0050156646 -0.0077086649 0.0032910131 -0.0017697962 -0.0061113044 -0.0072752026 0.0052210107 0.0075926486 -0.0028993342 0.0020606647 0.0060952641 0.0075405737 -0.0060417103 -0.0087050076 0.0031714079 -0.0019701660 -0.0065795077 -0.0065399629 -0.0024481480 0.0051730599 0.0012912283 0.0052610981 -0.0031005400 0.0002709823 -0.0086710450 -0.0033703913 0.0012299238 -0.0065458264 -0.0001612742 -0.0083483857 0.0090939106 0.0038300422 -0.0023653907 0.0057254504 0.0002714670 0.0081556411 -0.0086372552 -0.0036276092 0.0021888988 -0.0059318904 -0.0000631408 -0.0085515336 0.0088649981 0.0038101913 -0.0024381272 0.0059054116 0.0002597571 0.0083974414 -0.0087182838 -0.0037876362 0.0025931894 -0.0054538507 -0.0002306225 -0.0074056117 0.0097187148 0.0040926704 -0.0033283442 0.0057521998 0.0000405282 0.0080883160 0.0060635641 0.0047083543 -0.0079073447 -0.0049283602 0.0051492809 -0.0090074544 0.0009023260 -0.0056966496 0.0053317188 0.0045526982 -0.0028032422 0.0051786572 0.0009909384 0.0089406775 -0.0049421601 -0.0078246635 0.0014023190 -0.0069678458 0.0004196600 -0.0080136411 0.0049640231 0.0069496633 0.0000501329 0.0065523413 -0.0000559045 0.0084770819 -0.0058036307 -0.0075994455 -0.0008466552 -0.0063271013 0.0005750089 -0.0080922431 0.0062691843 0.0072028488 0.0010963213 0.0062556817 -0.0014468509 0.0074370663 -0.0070923621 -0.0080207251 -0.0010378952 -0.0065295999 0.0048426467 -0.0030511142 -0.0000940522 -0.0040940018 0.0028351993 0.0037076200 0.0033073583 0.0027549558 -0.0095503682 -0.0024964500 -0.0061628987 -0.0079439166 -0.0032193253 -0.0029735457 0.0085046814 0.0027719248 0.0058246432 0.0066232313 0.0033540291 0.0029393523 -0.0089751355 -0.0030633283 -0.0068947687 -0.0072463427 -0.0032252060 -0.0030891348 0.0089388476 0.0029207709 0.0062621349 0.0067021626 0.0030691697 0.0028098688 -0.0085760524 -0.0031594697 -0.0067482358 -0.0068253013 -0.0038027530 -0.0035074055 0.0097054845 0.0035091998 0.0072493716 0.0072437133 -0.0033795876 0.0019754972 0.0098898678 -0.0087175761 0.0058299862 0.0027472906 0.0037026480 0.0002927615 -0.0076479436 0.0073093964 -0.0019208024 -0.0019686721 -0.0030193277 -0.0005438591 0.0099996986 -0.0095414165 0.0037041036 0.0010633240 0.0027408111 0.0000517269 -0.0093296822 0.0086089906 -0.0040362444 -0.0010539872 -0.0026322984 -0.0001891334 0.0095542764 -0.0085337819 0.0041537364 0.0010224005 0.0027373639 -0.0001172518 -0.0092667511 0.0088008586 -0.0045829618 -0.0010391755 -0.0034130642 0.0002695781 0.0097478631 -0.0096987828 0.0046597294 0.0014749093 0.0047429085 0.0028549688 -0.0019929786 -0.0029579925 -0.0052740348 -0.0004658368 0.0016260124 0.0053235910 0.0089430737 -0.0042818464 0.0094770014 0.0006750619 -0.0018103172 -0.0044922027 -0.0087172323 0.0041954016 -0.0086865013 -0.0001234030 0.0019712048 0.0044943644 0.0084843237 -0.0043413507 0.0090815154 -0.0001416200 -0.0019637010 -0.0045466443 -0.0087714648 0.0042240147 -0.0088412587 -0.0000320665 0.0021608948 0.0045052227 0.0089617431 -0.0045457051 0.0092365120 -0.0002419975 -0.0022817815 -0.0046010261 -0.0090452750 0.0042950648 -0.0091516841 0.0002071338 0.0006481095 0.0062964956 -0.0022501231 0.0001304786 0.0060810301 -0.0001507687 -0.0047830301 -0.0060114512 0.0030682948 -0.0008182403 -0.0089261776 -0.0027958808 0.0050379321 0.0059877258 -0.0040400288 0.0012857349 0.0062282694 0.0005624896 -0.0051426681 -0.0063785039 0.0062228991 0.0016104599 -0.0098871357 -0.0026096302 0.0053909979 0.0058910931 -0.0060039008 -0.0012009499 0.0090327154 0.0019379572 -0.0042420711 -0.0054376954 0.0048274480 0.0017021949 -0.0095495180 -0.0023743513 0.0059646420 0.0068437010 -0.0062263501 -0.0009307936 0.0100711931 0.0022584007 -0.0045385390 -0.0038390689 -0.0020742879 0.0048350880 -0.0003040422 0.0040043461 -0.0000739668 0.0044860175 -0.0095938951 -0.0063641986 0.0081948531 -0.0011601348 -0.0005703099 -0.0038378960 0.0088091136 0.0060276434 -0.0076005872 0.0003960490 0.0007495772 0.0038980592 -0.0097574952 -0.0058427034 0.0071401958 -0.0008105883 -0.0007087550 -0.0037596788 0.0094687281 0.0058133206 -0.0072637310 0.0007455965 0.0004559388 0.0037449920 -0.0090990010 -0.0061849344 0.0076693380 -0.0006509920 -0.0003683722 -0.0037399654 0.0091083954 0.0068558888 -0.0079593923 0.0004887989 -0.0041785693 -0.0033085347 -0.0099391391 0.0010992644 -0.0086686320 -0.0047155547 0.0041444669 0.0050473738 0.0046410794 -0.0017685181 0.0072771303 0.0021305062 -0.0057336768 -0.0055699258 -0.0061937226 0.0041983008 -0.0093015686 -0.0017349994 0.0051679019 0.0054312729 0.0067123356 -0.0043805888 0.0083490859 0.0016979977 -0.0048874508 -0.0056225638 -0.0071451486 0.0052179029 -0.0086674068 -0.0009952081 0.0037009809 0.0053602660 0.0063372030 -0.0054895007 0.0085444053 0.0010325322 -0.0044641202 -0.0068608970 -0.0080134875 0.0046812922 -0.0087452524 -0.0012347375 0.0019178947 0.0055284201 -0.0013689927 -0.0032262804 -0.0030303526 0.0042755185 -0.0004228770 -0.0015445483 -0.0112473177 0.0087355651 -0.0033812205 -0.0043979128 0.0005260246 0.0012515938 0.0087458920 -0.0085855394 0.0032674478 0.0033579294 -0.0008319818 -0.0012226286 -0.0102432634 0.0078965071 -0.0028101746 -0.0036733070 0.0007363445 0.0010316223 0.0093871436 -0.0083948539 0.0029127655 0.0034160730 -0.0007739598 -0.0010094404 -0.0100571482 0.0090778023 -0.0032252336 -0.0034526963 0.0007927020 0.0010058366 0.0098796375 -0.0091271602 0.0030336631 0.0033250021 0.0016068320 0.0011423246 -0.0110996384 -0.0069211120 0.0035583433 -0.0070796821 -0.0023853874 -0.0024002683 0.0077777439 0.0035051286 -0.0049231428 0.0044570274 0.0033166766 0.0018227764 -0.0093494974 -0.0061470659 0.0067867063 -0.0045825908 -0.0028026737 -0.0012003045 0.0089696664 0.0060872213 -0.0058923165 0.0044296285 0.0029517439 0.0010706039 -0.0089544328 -0.0058176946 0.0055157532 -0.0041986721 -0.0025047303 -0.0011473749 0.0087537971 0.0059884187 -0.0053167791 0.0044435698 0.0020313467 0.0015062587 -0.0093642062 -0.0068498582 0.0060424388 -0.0055769091 -0.0012533027 -0.0053303062 0.0026400910 0.0028581222 0.0051712817 0.0008056977 -0.0001741565 -0.0054676357 -0.0092563096 -0.0097857339 -0.0009921656 -0.0047570724 -0.0002663894 0.0048218177 0.0083016322 0.0085420525 0.0006705364 0.0037070737 0.0000563669 -0.0048359898 -0.0079350983 -0.0103419341 -0.0004790998 -0.0038926276 -0.0004013736 0.0051717860 0.0084862681 0.0089218531 0.0005194863 0.0037961111 0.0002719523 -0.0050199908 -0.0081478887 -0.0081362590 -0.0006870687 -0.0036006233 -0.0002963890 0.0050970557 0.0082863862 0.0100793064 0.0005985649 0.0038025483 0.0001676797 -0.0054975481 -0.0081998018 -0.0091110987 -0.0012323792 -0.0036051858 -0.0009750767 0.0074299460 0.0060476329 0.0086220845 0.0027517253 0.0011237892 0.0011724268 0.0082479974 -0.0054442620 -0.0051313134 -0.0076284912 0.0010146730 0.0022698991 -0.0052956707 0.0084154449 0.0035373976 0.0083353407 0.0015042929 -0.0041576166 0.0051852339 -0.0059450346 -0.0069946022 0.0053575013 0.0052237645 0.0079277411 -0.0029291416 -0.0042040469 0.0076124030 0.0063032131 0.0038631900 -0.0073203437 -0.0032499385 -0.0055698317 -0.0069740066 0.0047384201 0.0026683494 -0.0019132697 0.0059500806 -0.0076157822 0.0038283391 0.0024187159 -0.0091291581 -0.0023261009 -0.0066257517 -0.0069281470 -0.0054991248 -0.0015565741 0.0067582077 0.0005615606 0.0078116089 0.0048772183 -0.0088724840 0.0053964525 -0.0024883771 -0.0093964824 -0.0032223492 0.0025272676 -0.0063694363 0.0001724716 -0.0084795809 0.0080378477 0.0003980469 -0.0035032077 0.0052849991 -0.0029428834 0.0066983816 0.0027407386 -0.0094268147 -0.0023190726 -0.0001193355 0.0035605104 -0.0087706305 -0.0063639864 0.0068627618 -0.0012219914 0.0009844039 -0.0007117676 0.0088610354 0.0079454141 -0.0044351824 0.0007284647 0.0068447890 0.0064732747 0.0027739471 0.0023938262 0.0050175524 0.0083560686 -0.0036780038 0.0092889389 -0.0000711403 -0.0043642269 -0.0041990159 -0.0056150843 0.0017229339 -0.0090193465 0.0023111329 -0.0081865776 -0.0035141144 0.0041118618 -0.0002494730 -0.0006116590 -0.0101191707 0.0081430569 -0.0023722600 -0.0037353445 0.0005943010 -0.0022296029 0.0089356402 -0.0092270691 -0.0002152193 0.0024599716 -0.0025229368 -0.0101971851 0.0006050993 --------------------------------------------------- Net gradient: 8.914392e-11 -1.052086e-10 -1.798055e-10 Net torque: -2.112036e-03 -3.218353e-03 -3.421061e-03 Total processing time: 274.44 sec Job finished: Mon Sep 4 16:29:06 2017