GRRM 23 January 23, 2023 Saddle wB97XD def2svpp 0 1 1 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,24,5,21,8,18,15,11,33,14,31;35,39,42,45,46/CRV:10.3,11.3;4.3,5.1/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOHC3HCHHHCHHCHHC3O1H/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s45;s45;/rC:-5.5441,-.0792,2.0862;-6.1212,-.981,2.3553;-5.7722,.1536,1.0323;-5.9199,.7569,2.7036;-4.0437,-.28,2.2907;-3.5036,.6017,1.9023;-3.6996,-1.1402,1.6864;-3.6312,-.493,3.7493;-3.928,.3945,4.3377;-2.5293,-.5481,3.8089;-4.226,-1.751,4.378;-4.0572,-2.6277,3.7259;-5.3262,-1.6702,4.4715;-3.7006,-2.1321,5.7349;-2.0383,-1.7762,7.6014;-1.6166,-2.7179,7.2051;-2.497,-2.058,8.5677;-.9134,-.7663,7.8167;-1.336,.179,8.211;-.4687,-.5146,6.8362;.1666,-1.2712,8.7707;.6312,-2.1799,8.3414;-.3153,-1.5907,9.7133;1.2577,-.247,9.0935;1.9354,-.6828,9.8494;.7947,.6369,9.5718;2.0802,.2019,7.8865;1.4668,.7504,7.1508;2.902,.8712,8.1936;2.5286,-.665,7.3681;-3.9893,-3.3284,6.1352;-4.3384,-3.1989,7.1758;-3.0792,-1.2539,6.6254;-2.9199,-.2338,6.268;-4.3102,1.9125,7.2288;-3.2168,1.9497,7.382;-4.6661,2.9485,7.0956;-4.5001,1.3773,6.283;-5.016,1.2479,8.4087;-4.9242,1.9037,9.2927;-6.0993,1.1837,8.1951;-4.5059,-.1383,8.8066;-5.0331,-.4613,9.7218;-3.4375,-.1033,9.0802;-4.7797,-1.2575,7.8063;-4.7999,-2.4559,8.2301;-5.5173,-.9663,7.02; -739.260455535342 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.002796690090 0.000447744111 0.034724609441 0.008421902950 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.135244555 0.000038887 0.000087688 0.000115647 0.000235631 0.000324420 0.000570100 0.001002530 0.001030743 0.001167239 0.001392798 0.001934235 0.002176447 0.003539870 0.003854185 0.004228349 0.004962137 0.005762032 0.006379125 0.006734308 0.008512937 0.012266366 0.013825426 0.014536816 0.015396802 0.017456166 0.021657584 0.023777632 0.028154210 0.030206728 0.032385213 0.032923198 0.033373841 0.036038876 0.039242732 0.041064265 0.044256250 0.044643128 0.046128280 0.046971139 0.047755601 0.051988056 0.053037177 0.053563140 0.053893624 0.055486876 0.056907776 0.058021020 0.059795763 0.064924197 0.067455592 0.070128795 0.070813961 0.073690654 0.075469642 0.076991114 0.078040253 0.080872080 0.081317013 0.084484984 0.091301448 0.096310055 0.099457291 0.102025534 0.106129834 0.110587853 0.111513880 0.112564934 0.115422284 0.117321347 0.126936868 0.128588165 0.131753704 0.135980317 0.139451846 0.142364315 0.144236157 0.151084939 0.162439176 0.166852430 0.169556204 0.172786566 0.179273645 0.184831911 0.197766550 0.205842296 0.206658464 0.216083978 0.225625271 0.236305876 0.239055083 0.274538394 0.290640763 0.311199924 0.351686715 0.370544882 0.397434819 0.428995534 0.470256921 0.522110446 0.532687537 0.599770856 0.607517764 0.618745736 0.628127671 0.704674039 0.758503833 0.760085954 0.764387935 0.768586069 0.773216186 0.777524735 0.788198619 0.793817310 0.796781684 0.799276443 0.801242185 0.812571274 0.838863098 0.841222854 0.843934474 0.847399023 0.851343892 0.862600391 0.879588528 0.893570095 0.902541447 0.907320553 0.915038416 0.923784221 0.924474638 0.934539451 1.056927736 1.082245235 1.279473806 2 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.5533,-.0793,2.0811;-6.1305,-.9801,2.3529;-5.782,.1514,1.0268;-5.9279,.7586,2.6969;-4.053,-.2807,2.285;-3.5124,.5996,1.8938;-3.71,-1.1429,1.6829;-3.639,-.4903,3.7436;-3.9343,.3993,4.33;-2.5371,-.5456,3.8011;-4.2312,-1.7467,4.3779;-4.0675,-2.6236,3.725;-5.3308,-1.6651,4.4781;-3.6942,-2.1301,5.7312;-2.0287,-1.7734,7.5998;-1.6083,-2.722,7.2182;-2.4995,-2.0439,8.5639;-.9009,-.7673,7.8216;-1.3231,.1797,8.2126;-.4504,-.5177,6.8433;.1753,-1.2717,8.7803;.6404,-2.1818,8.3544;-.3085,-1.5885,9.723;1.2666,-.247,9.1019;1.9456,-.682,9.8572;.8039,.637,9.5804;2.087,.202,7.8935;1.4726,.7516,7.1595;2.9102,.8704,8.199;2.5334,-.665,7.3734;-3.9896,-3.3224,6.1385;-4.3609,-3.1756,7.1863;-3.053,-1.2534,6.6074;-2.8851,-.2364,6.2449;-4.3135,1.9035,7.2295;-3.2205,1.9388,7.3856;-4.6673,2.9394,7.0905;-4.5015,1.3631,6.2863;-5.0227,1.2457,8.4109;-4.9258,1.9011,9.2945;-6.1067,1.1871,8.1991;-4.5173,-.1425,8.8062;-5.0379,-.4645,9.7258;-3.4466,-.1143,9.071;-4.7955,-1.2538,7.805;-4.8055,-2.4545,8.2184;-5.5203,-.9671,7.0074; -739.260633132617 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.001610545429 0.000276289027 0.023830640384 0.008421645927 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.135455303 0.000010725 0.000050001 0.000091716 0.000219822 0.000312043 0.000555570 0.001000994 0.001028024 0.001165909 0.001381228 0.001888304 0.002180136 0.003593043 0.003854702 0.004316680 0.004979439 0.005882198 0.006384391 0.006725871 0.008618810 0.012621414 0.013913612 0.014634256 0.015404517 0.017704014 0.021845028 0.024369448 0.028156529 0.030218576 0.032429761 0.032926050 0.033374943 0.036122373 0.039328621 0.041161226 0.044259603 0.044647741 0.046160200 0.046971236 0.047764834 0.052021254 0.053037246 0.053571712 0.053890691 0.055591607 0.056918846 0.058026423 0.059800074 0.064924456 0.067461386 0.070128771 0.070822988 0.073691045 0.075471347 0.076994899 0.078042067 0.080872136 0.081321641 0.084485447 0.091303614 0.096320462 0.099458233 0.102027363 0.106169720 0.110589845 0.111514260 0.112574105 0.115423724 0.117326842 0.127004788 0.128673372 0.131772728 0.135982811 0.139475349 0.142366598 0.144253258 0.151104273 0.162439593 0.166855427 0.169557126 0.172788738 0.179274907 0.184835489 0.197796600 0.205876989 0.206660081 0.216087794 0.225657919 0.236337484 0.239060190 0.274551848 0.290897850 0.311203509 0.351711474 0.370578341 0.397496402 0.429002617 0.470257031 0.522122205 0.532690684 0.599772479 0.607518253 0.618745670 0.628133857 0.704707465 0.758506482 0.760131172 0.764387950 0.768586400 0.773227864 0.777524858 0.788199337 0.793820759 0.796781803 0.799284796 0.801243279 0.812571405 0.838874087 0.841231905 0.843941700 0.847437477 0.851350184 0.862600653 0.879592805 0.893577125 0.902550184 0.907329495 0.915039380 0.923785172 0.924482756 0.934599354 1.057101579 1.082269308 1.279481014 3 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.5715,-.0828,2.0815;-6.1473,-.982,2.362;-5.8058,.1408,1.0268;-5.9433,.7592,2.6934;-4.0699,-.2823,2.2781;-3.5324,.5963,1.879;-3.7303,-1.1472,1.6778;-3.6454,-.4852,3.7351;-3.9382,.4059,4.3204;-2.5429,-.5383,3.7845;-4.2314,-1.7408,4.3766;-4.0761,-2.6183,3.7226;-5.3303,-1.6573,4.4872;-3.6878,-2.1267,5.727;-2.0208,-1.7703,7.5971;-1.6015,-2.7196,7.2171;-2.494,-2.0396,8.5599;-.8907,-.7667,7.8228;-1.3119,.1827,8.209;-.4326,-.5212,6.8469;.1786,-1.2718,8.7899;.6439,-2.1845,8.3698;-.3114,-1.5843,9.7308;1.2719,-.2502,9.1163;1.9468,-.6879,9.8737;.8105,.6348,9.5941;2.0988,.1978,7.9118;1.4894,.7517,7.1768;2.9237,.8621,8.2218;2.5435,-.6699,7.3914;-3.9844,-3.3175,6.1325;-4.3585,-3.1713,7.181;-3.0467,-1.2505,6.6056;-2.8727,-.2359,6.2375;-4.3189,1.8993,7.2237;-3.2257,1.9354,7.3776;-4.6735,2.9342,7.0798;-4.5085,1.3533,6.284;-5.0247,1.2457,8.4091;-4.9244,1.902,9.2917;-6.1094,1.1868,8.2012;-4.5169,-.1419,8.802;-5.0394,-.47,9.718;-3.4471,-.1118,9.0695;-4.7863,-1.2498,7.7942;-4.8009,-2.4514,8.2099;-5.511,-.9618,6.9973; -739.260675085369 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000668675660 0.000137184610 0.027020120692 0.008419754508 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.135513136 0.000014695 0.000071310 0.000091421 0.000224555 0.000354465 0.000585524 0.001005981 0.001038797 0.001166317 0.001391870 0.001933833 0.002180337 0.003615149 0.003879066 0.004309328 0.004976749 0.005928573 0.006384318 0.006726575 0.008614017 0.012622981 0.013913692 0.014637529 0.015404842 0.017714507 0.021857993 0.024435232 0.028162896 0.030219373 0.032438115 0.032926019 0.033375324 0.036133395 0.039346732 0.041182425 0.044262999 0.044648517 0.046172759 0.046971297 0.047767413 0.052043943 0.053037241 0.053574353 0.053894539 0.055619475 0.056924072 0.058026924 0.059801092 0.064927068 0.067493314 0.070128767 0.070830723 0.073691911 0.075474676 0.076997048 0.078042519 0.080872101 0.081325965 0.084485492 0.091303896 0.096325402 0.099459364 0.102029538 0.106181092 0.110593960 0.111514317 0.112578148 0.115424705 0.117326993 0.127031105 0.128715947 0.131782649 0.135983417 0.139486696 0.142369842 0.144269264 0.151111893 0.162439570 0.166858066 0.169557204 0.172790364 0.179278153 0.184837224 0.197812635 0.205884493 0.206660582 0.216095604 0.225663922 0.236351895 0.239062979 0.274565123 0.290930742 0.311203839 0.351722210 0.370604639 0.397497292 0.429007112 0.470257811 0.522125650 0.532693620 0.599774731 0.607518488 0.618748764 0.628134172 0.704719815 0.758506753 0.760133439 0.764388773 0.768586807 0.773232557 0.777525584 0.788201598 0.793821824 0.796782684 0.799286650 0.801243619 0.812573855 0.838874849 0.841241643 0.843954306 0.847446553 0.851350254 0.862600846 0.879597101 0.893586573 0.902561536 0.907332488 0.915046304 0.923785373 0.924489735 0.934651112 1.057144523 1.082290338 1.279481863 4 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.5907,-.0848,2.0894;-6.1626,-.9847,2.3752;-5.8329,.1368,1.0361;-5.9599,.7572,2.7028;-4.0871,-.281,2.2758;-3.5544,.5987,1.8726;-3.7499,-1.1453,1.6735;-3.6524,-.4828,3.73;-3.9435,.4075,4.3173;-2.5495,-.5333,3.7723;-4.2313,-1.74,4.3747;-4.0765,-2.6169,3.7198;-5.3297,-1.66,4.4904;-3.6794,-2.1252,5.7221;-2.0133,-1.7682,7.592;-1.5934,-2.7176,7.2125;-2.489,-2.0383,8.5535;-.8834,-.7658,7.8226;-1.3052,.1847,8.2056;-.4194,-.5219,6.8491;.1789,-1.2725,8.7966;.6449,-2.1862,8.3797;-.3182,-1.5841,9.7341;1.2721,-.2535,9.1308;1.9402,-.6928,9.8934;.8092,.6328,9.605;2.109,.1921,7.9323;1.5063,.747,7.1925;2.9332,.8546,8.2483;2.5556,-.6768,7.4157;-3.972,-3.3168,6.1292;-4.3514,-3.1678,7.1783;-3.0357,-1.248,6.5971;-2.8643,-.2325,6.2308;-4.3217,1.8999,7.2132;-3.2283,1.9397,7.3649;-4.6799,2.9334,7.0682;-4.5114,1.3517,6.2749;-5.0232,1.2463,8.4011;-4.9221,1.9036,9.2827;-6.1084,1.1849,8.1959;-4.5118,-.14,8.7942;-5.0324,-.4684,9.7115;-3.4415,-.1069,9.0602;-4.7817,-1.2484,7.7872;-4.7951,-2.4497,8.2021;-5.5043,-.9613,6.988; -739.260699052477 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000385517520 0.000073377998 0.027711701465 0.008423198031 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.135512983 0.000034237 0.000088702 0.000110692 0.000246542 0.000347462 0.000577586 0.001006095 0.001037479 0.001168930 0.001390322 0.001933885 0.002180441 0.003614701 0.003879057 0.004314616 0.004979919 0.005928493 0.006384465 0.006726565 0.008615088 0.012623214 0.013913793 0.014637270 0.015404960 0.017718357 0.021862045 0.024450263 0.028165443 0.030219333 0.032439939 0.032926000 0.033375506 0.036134911 0.039348019 0.041186508 0.044263790 0.044648469 0.046176827 0.046971265 0.047767197 0.052052414 0.053037231 0.053574157 0.053896027 0.055624192 0.056924999 0.058027062 0.059801851 0.064926733 0.067512507 0.070128789 0.070832808 0.073692576 0.075475957 0.076998436 0.078042547 0.080872070 0.081330692 0.084485502 0.091304185 0.096325906 0.099459594 0.102029995 0.106184315 0.110594306 0.111514491 0.112579232 0.115424783 0.117327151 0.127034172 0.128730328 0.131783804 0.135983338 0.139490415 0.142369724 0.144270905 0.151118402 0.162440843 0.166858212 0.169557350 0.172791596 0.179280937 0.184837208 0.197816825 0.205885006 0.206661763 0.216095489 0.225668719 0.236353228 0.239063156 0.274566834 0.290931028 0.311203853 0.351723593 0.370607077 0.397498191 0.429008713 0.470257708 0.522127615 0.532693609 0.599774872 0.607518504 0.618749769 0.628136703 0.704721773 0.758507409 0.760133591 0.764388952 0.768587092 0.773232576 0.777526495 0.788205468 0.793821952 0.796782811 0.799286718 0.801244877 0.812574709 0.838875006 0.841248199 0.843965306 0.847447257 0.851350275 0.862601632 0.879598132 0.893590834 0.902567194 0.907332435 0.915051359 0.923786146 0.924489943 0.934673402 1.057144754 1.082330673 1.279494055 5 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.6104,-.0861,2.098;-6.1784,-.9875,2.387;-5.8606,.1357,1.0466;-5.9771,.7546,2.7146;-4.1051,-.2792,2.2734;-3.5773,.6019,1.8669;-3.7703,-1.1424,1.6679;-3.6591,-.4812,3.7243;-3.949,.4075,4.3146;-2.5558,-.5283,3.7588;-4.2299,-1.7408,4.3713;-4.0745,-2.617,3.7155;-5.3282,-1.6651,4.4915;-3.6731,-2.1246,5.7169;-2.0064,-1.7665,7.5855;-1.5842,-2.7143,7.2045;-2.4839,-2.04,8.5451;-.8778,-.7639,7.8228;-1.3015,.1866,8.2034;-.4073,-.5201,6.8524;.1775,-1.2717,8.804;.6446,-2.1866,8.3909;-.3264,-1.5818,9.7384;1.2706,-.2548,9.1451;1.9314,-.6944,9.9139;.8062,.6335,9.614;2.1185,.1863,7.9527;1.523,.7403,7.2063;2.941,.8482,8.2739;2.5681,-.6847,7.4422;-3.9633,-3.3164,6.1249;-4.3425,-3.1674,7.174;-3.029,-1.2465,6.5911;-2.858,-.231,6.2241;-4.3203,1.9002,7.2034;-3.2268,1.9416,7.3541;-4.6801,2.9329,7.057;-4.51,1.3501,6.2662;-5.0199,1.2473,8.3929;-4.9186,1.9059,9.2736;-6.1052,1.1845,8.1889;-4.5065,-.1379,8.7868;-5.0265,-.4666,9.7042;-3.4363,-.1035,9.0526;-4.7743,-1.2472,7.7804;-4.7871,-2.4484,8.197;-5.4977,-.9617,6.9816; -739.260716328003 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000405346277 0.000054796022 0.027717036177 0.008418261345 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.135512899 0.000039486 0.000086447 0.000122171 0.000239360 0.000346140 0.000583436 0.001006185 0.001037469 0.001169202 0.001391896 0.001934839 0.002180638 0.003615823 0.003879142 0.004314822 0.004980085 0.005928426 0.006384846 0.006726553 0.008615289 0.012623956 0.013913785 0.014637747 0.015404942 0.017719288 0.021863267 0.024454079 0.028165966 0.030219392 0.032440219 0.032925972 0.033375474 0.036135137 0.039348336 0.041187757 0.044264089 0.044648561 0.046177735 0.046971269 0.047767126 0.052053327 0.053037165 0.053574153 0.053896080 0.055624042 0.056925731 0.058026822 0.059802189 0.064926430 0.067514656 0.070128743 0.070834762 0.073692679 0.075476035 0.076998598 0.078042600 0.080872367 0.081331874 0.084485626 0.091304223 0.096325886 0.099459679 0.102030226 0.106184534 0.110594313 0.111514515 0.112579406 0.115425201 0.117327376 0.127036136 0.128732177 0.131783979 0.135983280 0.139490664 0.142369675 0.144272574 0.151118630 0.162440790 0.166858199 0.169557239 0.172791596 0.179280994 0.184837289 0.197819000 0.205885092 0.206661980 0.216096274 0.225668609 0.236351145 0.239064511 0.274567210 0.290931899 0.311204178 0.351723662 0.370607406 0.397498294 0.429008810 0.470257748 0.522127659 0.532693731 0.599774935 0.607518546 0.618749839 0.628136834 0.704721809 0.758507404 0.760133654 0.764388981 0.768587372 0.773233282 0.777526732 0.788205914 0.793821969 0.796782828 0.799286713 0.801245066 0.812574882 0.838875053 0.841249073 0.843965697 0.847447029 0.851350326 0.862601671 0.879600186 0.893591190 0.902567686 0.907333971 0.915054528 0.923786013 0.924491341 0.934674647 1.057145577 1.082354099 1.279496323 6 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.6299,-.087,2.1082;-6.1936,-.9905,2.3989;-5.8883,.1368,1.0591;-5.9945,.7512,2.7295;-4.1228,-.2765,2.2723;-3.6005,.6069,1.8639;-3.7902,-1.1374,1.6624;-3.666,-.4805,3.7195;-3.9552,.4058,4.3138;-2.5624,-.5237,3.7464;-4.2281,-1.7435,4.3671;-4.0695,-2.6183,3.7103;-5.3265,-1.6741,4.4899;-3.6668,-2.1258,5.7114;-2,-1.7667,7.5795;-1.5756,-2.7133,7.1978;-2.4797,-2.0428,8.5374;-.8733,-.7635,7.8223;-1.2991,.1873,8.1997;-.3967,-.5203,6.8547;.1755,-1.271,8.8108;.6447,-2.1866,8.4015;-.335,-1.5802,9.7419;1.2669,-.2549,9.1589;1.9206,-.6938,9.9342;.7997,.635,9.6221;2.1255,.1825,7.9728;1.5368,.7345,7.2196;2.9454,.8449,8.2996;2.5792,-.6902,7.4689;-3.9557,-3.3172,6.1214;-4.3367,-3.1658,7.1709;-3.0213,-1.2467,6.5835;-2.8504,-.2314,6.2159;-4.3158,1.9011,7.1939;-3.2223,1.9439,7.3439;-4.6767,2.9334,7.0467;-4.5055,1.35,6.2573;-5.0142,1.2488,8.3843;-4.9127,1.908,9.2644;-6.0995,1.1851,8.181;-4.4996,-.1359,8.7789;-5.0186,-.4641,9.697;-3.4292,-.1006,9.0438;-4.768,-1.2459,7.7734;-4.781,-2.4466,8.1908;-5.4908,-.9609,6.9739; -739.260728658528 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000350704587 0.000047615582 0.027065172869 0.008424831748 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.135512694 0.000038811 0.000085725 0.000126766 0.000244271 0.000344066 0.000582843 0.001006194 0.001037420 0.001169208 0.001392006 0.001934805 0.002180673 0.003615706 0.003879122 0.004314853 0.004980096 0.005928315 0.006384975 0.006726364 0.008615262 0.012623998 0.013913780 0.014637543 0.015404958 0.017719469 0.021863972 0.024456048 0.028166227 0.030219345 0.032440354 0.032925944 0.033375436 0.036135117 0.039348425 0.041187962 0.044264261 0.044648743 0.046178049 0.046971177 0.047766916 0.052053726 0.053037011 0.053573855 0.053896327 0.055624173 0.056925638 0.058026462 0.059802187 0.064925787 0.067515344 0.070128681 0.070834569 0.073692706 0.075476278 0.076998516 0.078042587 0.080872199 0.081331891 0.084485650 0.091304209 0.096325950 0.099459685 0.102030417 0.106184759 0.110594361 0.111514536 0.112579332 0.115425062 0.117327376 0.127036380 0.128733200 0.131784175 0.135983052 0.139490700 0.142369597 0.144272622 0.151119036 0.162440785 0.166858195 0.169557109 0.172791522 0.179280956 0.184837488 0.197819252 0.205885033 0.206662111 0.216096235 0.225669147 0.236348709 0.239065892 0.274567296 0.290931866 0.311204565 0.351723724 0.370607351 0.397498307 0.429008951 0.470257711 0.522127708 0.532693709 0.599774969 0.607518600 0.618749893 0.628136684 0.704721709 0.758507364 0.760133604 0.764389022 0.768587378 0.773233314 0.777526737 0.788205982 0.793821974 0.796782834 0.799286898 0.801245081 0.812574937 0.838875276 0.841249136 0.843966514 0.847447058 0.851350291 0.862601748 0.879600070 0.893591292 0.902568242 0.907334109 0.915054685 0.923785739 0.924491358 0.934675239 1.057146507 1.082364284 1.279497266 7 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.6495,-.089,2.1171;-6.2086,-.9949,2.4091;-5.9153,.1369,1.0704;-6.0125,.7465,2.743;-4.1408,-.2743,2.2709;-3.6239,.6117,1.8611;-3.8096,-1.1328,1.6569;-3.6739,-.4801,3.7147;-3.9631,.4036,4.3128;-2.5699,-.5188,3.7347;-4.2271,-1.7468,4.3625;-4.0651,-2.6201,3.7043;-5.3256,-1.6838,4.4878;-3.6619,-2.1277,5.7055;-1.9942,-1.7675,7.5725;-1.567,-2.7122,7.1896;-2.4757,-2.047,8.5284;-.8697,-.7632,7.8215;-1.2984,.1877,8.1957;-.387,-.5202,6.8569;.1725,-1.2698,8.8175;.6445,-2.1858,8.4123;-.3445,-1.5781,9.7453;1.2616,-.2535,9.1725;1.9085,-.6911,9.9542;.7911,.6376,9.63;2.1304,.1808,7.9929;1.5482,.7305,7.233;2.9474,.8443,8.325;2.5888,-.6932,7.4954;-3.9495,-3.3188,6.117;-4.3311,-3.1659,7.1666;-3.0151,-1.2477,6.5761;-2.8438,-.233,6.2072;-4.3053,1.9026,7.1869;-3.2119,1.944,7.3379;-4.6649,2.9353,7.0397;-4.4947,1.3521,6.25;-5.0056,1.2506,8.3763;-4.9046,1.9096,9.2567;-6.0908,1.188,8.1719;-4.4929,-.1346,8.7714;-5.0131,-.4621,9.6891;-3.4228,-.1006,9.0373;-4.7615,-1.2447,7.7662;-4.7753,-2.4453,8.1849;-5.4844,-.9599,6.9668; -739.260737026842 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000161782359 0.000032329264 0.025541774280 0.008414665894 0.000300000000 0.000200000000 0.002781514636 0.001854343091 -0.135512827 0.000040653 0.000085176 0.000124919 0.000241565 0.000344814 0.000584176 0.001006201 0.001037393 0.001169243 0.001392376 0.001934791 0.002180803 0.003615754 0.003879105 0.004315043 0.004980172 0.005928183 0.006384936 0.006726224 0.008615337 0.012624033 0.013913866 0.014637407 0.015404967 0.017719749 0.021864284 0.024456808 0.028166299 0.030219304 0.032440394 0.032925895 0.033375376 0.036135116 0.039348567 0.041188032 0.044264289 0.044648822 0.046178125 0.046971078 0.047766684 0.052053874 0.053036793 0.053573579 0.053896424 0.055624099 0.056925587 0.058026067 0.059802252 0.064924980 0.067515404 0.070128444 0.070834727 0.073692735 0.075475797 0.076998305 0.078042583 0.080872081 0.081331928 0.084485738 0.091304188 0.096325897 0.099459686 0.102030461 0.106184800 0.110594285 0.111514519 0.112579206 0.115424922 0.117327395 0.127036543 0.128733156 0.131784219 0.135982812 0.139490698 0.142369489 0.144272821 0.151118890 0.162440767 0.166858192 0.169556943 0.172791348 0.179280972 0.184837536 0.197819454 0.205885011 0.206662092 0.216096435 0.225668737 0.236345539 0.239066011 0.274567333 0.290931860 0.311204557 0.351723792 0.370607347 0.397498321 0.429008970 0.470257670 0.522127839 0.532693747 0.599774969 0.607518612 0.618749965 0.628136586 0.704721645 0.758507285 0.760133643 0.764389008 0.768587411 0.773233395 0.777526729 0.788206098 0.793822025 0.796782827 0.799286840 0.801245078 0.812574967 0.838875266 0.841249228 0.843966467 0.847446705 0.851350251 0.862601754 0.879600060 0.893591310 0.902568329 0.907334203 0.915054868 0.923785326 0.924491440 0.934675317 1.057146510 1.082366085 1.279497351 8 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.6685,-.0928,2.1252;-6.222,-1.0022,2.417;-5.9409,.1354,1.0807;-6.032,.7389,2.7557;-4.1581,-.2717,2.2703;-3.6475,.618,1.8605;-3.8262,-1.1268,1.652;-3.6827,-.4795,3.7111;-3.974,.4005,4.3134;-2.5784,-.5121,3.7254;-4.2256,-1.7513,4.3575;-4.0576,-2.6224,3.6979;-5.3244,-1.6969,4.4836;-3.6574,-2.1304,5.6998;-1.9893,-1.7695,7.566;-1.5593,-2.7127,7.1823;-2.4729,-2.052,8.5201;-.8672,-.764,7.8207;-1.2986,.1865,8.1924;-.3793,-.5207,6.8589;.1696,-1.2696,8.8229;.645,-2.185,8.4206;-.353,-1.5787,9.7473;1.2551,-.2521,9.1853;1.8967,-.6887,9.9719;.7806,.6388,9.6388;2.1321,.1822,8.0118;1.5548,.7301,7.2469;2.9455,.8474,8.3494;2.5955,-.6917,7.5188;-3.9451,-3.3208,6.1134;-4.3285,-3.1651,7.1627;-3.0089,-1.2498,6.5682;-2.8367,-.2356,6.1982;-4.29,1.9051,7.1818;-3.1968,1.9433,7.3351;-4.6465,2.939,7.0353;-4.4789,1.3565,6.2436;-4.9946,1.2534,8.3688;-4.894,1.9113,9.2501;-6.0795,1.1935,8.1618;-4.4861,-.1333,8.7641;-5.0084,-.4595,9.681;-3.4162,-.1024,9.0315;-4.7565,-1.243,7.7589;-4.7725,-2.4433,8.1781;-5.4784,-.9572,6.9589; -739.260742269387 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000264425522 0.000035845480 0.024505173277 0.008405328491 0.000300000000 0.000200000000 0.001701802445 0.001134534964 -0.135512876 0.000048798 0.000084100 0.000114817 0.000243304 0.000344741 0.000584001 0.001006208 0.001037416 0.001169306 0.001392496 0.001934777 0.002180740 0.003615630 0.003879123 0.004314979 0.004980106 0.005928119 0.006384904 0.006725954 0.008615186 0.012624169 0.013913831 0.014637291 0.015404993 0.017719604 0.021864254 0.024457167 0.028166372 0.030219270 0.032440414 0.032925844 0.033375305 0.036135131 0.039348435 0.041187841 0.044264280 0.044648900 0.046178154 0.046970968 0.047766385 0.052053935 0.053036521 0.053573070 0.053896503 0.055624133 0.056925538 0.058025773 0.059802263 0.064924303 0.067515481 0.070128149 0.070834598 0.073692754 0.075475504 0.076998047 0.078042575 0.080871999 0.081331750 0.084485731 0.091304139 0.096325850 0.099459676 0.102030486 0.106184802 0.110594111 0.111514511 0.112579074 0.115424672 0.117327402 0.127036635 0.128733097 0.131784109 0.135982581 0.139490616 0.142369109 0.144272992 0.151118823 0.162440750 0.166858203 0.169556734 0.172791181 0.179280991 0.184837602 0.197819565 0.205885008 0.206661917 0.216095943 0.225668402 0.236342447 0.239066200 0.274567203 0.290931860 0.311204230 0.351723806 0.370607296 0.397498342 0.429008969 0.470257630 0.522127896 0.532693683 0.599774937 0.607518622 0.618750013 0.628136378 0.704721494 0.758507219 0.760133674 0.764389000 0.768587389 0.773233426 0.777526737 0.788206094 0.793822022 0.796782787 0.799286772 0.801245066 0.812574951 0.838875229 0.841249208 0.843966445 0.847446385 0.851350195 0.862601749 0.879599969 0.893591299 0.902568388 0.907334256 0.915054896 0.923784823 0.924491399 0.934675204 1.057146463 1.082367567 1.279497733 9 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.6864,-.0982,2.1311;-6.234,-1.0114,2.4223;-5.9642,.1318,1.0884;-6.0517,.7296,2.7657;-4.1745,-.2696,2.2696;-3.6704,.624,1.8603;-3.8407,-1.1211,1.6475;-3.6921,-.4789,3.7078;-3.9865,.3976,4.3139;-2.5876,-.5048,3.7177;-4.2251,-1.7556,4.3525;-4.0515,-2.6242,3.6911;-5.3242,-1.7093,4.4796;-3.6541,-2.1333,5.694;-1.9851,-1.7717,7.5592;-1.552,-2.7129,7.174;-2.4705,-2.0578,8.5112;-.8658,-.7645,7.8199;-1.3004,.1854,8.1893;-.3729,-.5204,6.8607;.166,-1.2688,8.8279;.6452,-2.1835,8.4284;-.3617,-1.5787,9.7492;1.2478,-.2498,9.197;1.8844,-.6849,9.9885;.7689,.6409,9.6464;2.1325,.1846,8.0293;1.5597,.7302,7.2594;2.942,.8519,8.3719;2.6013,-.6891,7.5411;-3.9413,-3.3231,6.1092;-4.3259,-3.1654,7.1582;-3.004,-1.252,6.5608;-2.831,-.2385,6.1894;-4.2705,1.9082,7.1796;-3.1777,1.9413,7.3368;-4.622,2.9441,7.035;-4.4585,1.3634,6.2391;-4.9821,1.2562,8.3624;-4.8829,1.9121,9.2453;-6.0663,1.2004,8.1509;-4.4799,-.1329,8.7576;-5.0059,-.4575,9.673;-3.4107,-.1066,9.0279;-4.7519,-1.2415,7.7518;-4.7702,-2.4418,8.1715;-5.4731,-.9545,6.9518; -739.260744975290 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000117548660 0.000026527900 0.028034357730 0.007761883464 0.000300000000 0.000200000000 0.003828201876 0.002552134584 -0.135512904 0.000043606 0.000081211 0.000123879 0.000243548 0.000345706 0.000583866 0.001006223 0.001037531 0.001169384 0.001392716 0.001934857 0.002180710 0.003615612 0.003879085 0.004314943 0.004980074 0.005928039 0.006384797 0.006725738 0.008615084 0.012624202 0.013913847 0.014637166 0.015404994 0.017719545 0.021864088 0.024457311 0.028166355 0.030219222 0.032440413 0.032925798 0.033375224 0.036135156 0.039348344 0.041187649 0.044264224 0.044649007 0.046178198 0.046970858 0.047766055 0.052053956 0.053036161 0.053572589 0.053896518 0.055624071 0.056925458 0.058025576 0.059802240 0.064923483 0.067515512 0.070127472 0.070834676 0.073692774 0.075475054 0.076997717 0.078042578 0.080871936 0.081331665 0.084485720 0.091304088 0.096325778 0.099459668 0.102030502 0.106184788 0.110593917 0.111514505 0.112578833 0.115424400 0.117327392 0.127036598 0.128732934 0.131783973 0.135982332 0.139490489 0.142368778 0.144273108 0.151118729 0.162440742 0.166858225 0.169556510 0.172790982 0.179281043 0.184837636 0.197819698 0.205885034 0.206661881 0.216095525 0.225668085 0.236339473 0.239066471 0.274567092 0.290931869 0.311204146 0.351723791 0.370607276 0.397498413 0.429008978 0.470257588 0.522128032 0.532693725 0.599774818 0.607518621 0.618750057 0.628136128 0.704721399 0.758507118 0.760133760 0.764388977 0.768587417 0.773233501 0.777526742 0.788206133 0.793822042 0.796782733 0.799286731 0.801245076 0.812574984 0.838875217 0.841249212 0.843966366 0.847446042 0.851350188 0.862601767 0.879599933 0.893591270 0.902568673 0.907334287 0.915055276 0.923784267 0.924491367 0.934675046 1.057146445 1.082368701 1.279497973 10 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.7,-.1068,2.1331;-6.2412,-1.0245,2.4225;-5.9809,.1243,1.0916;-6.0699,.7168,2.7706;-4.1868,-.2686,2.269;-3.6892,.6293,1.861;-3.8484,-1.1164,1.6444;-3.7008,-.4781,3.7059;-4.0001,.395,4.3145;-2.5962,-.4966,3.714;-4.2246,-1.7596,4.3485;-4.044,-2.626,3.6859;-5.3241,-1.7219,4.4747;-3.6525,-2.1355,5.6899;-1.983,-1.7742,7.5544;-1.5477,-2.7139,7.1681;-2.4702,-2.0632,8.5047;-.8655,-.7663,7.82;-1.3018,.1822,8.1906;-.3706,-.5193,6.8627;.1643,-1.2718,8.8292;.6472,-2.1834,8.4273;-.3654,-1.5871,9.7473;1.242,-.2512,9.2061;1.8782,-.6884,9.9963;.7595,.6353,9.6595;2.1274,.1928,8.043;1.5545,.7408,7.2754;2.9342,.8608,8.3909;2.5996,-.6765,7.5507;-3.9406,-3.3246,6.107;-4.3268,-3.1642,7.1554;-3.0008,-1.2539,6.5551;-2.8262,-.2411,6.1825;-4.249,1.9124,7.1801;-3.1566,1.9387,7.3419;-4.5939,2.9508,7.0376;-4.4363,1.3719,6.237;-4.9692,1.2606,8.3578;-4.8713,1.9141,9.2427;-6.0527,1.2102,8.1411;-4.4752,-.1314,8.753;-5.0059,-.454,9.6665;-3.4069,-.111,9.0271;-4.7495,-1.2388,7.7466;-4.771,-2.439,8.1664;-5.4695,-.9498,6.9461; -739.260745351765 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000395070657 0.000075475796 0.018374496751 0.005610654929 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.135512920 0.000025130 0.000080649 0.000128520 0.000254356 0.000351931 0.000583785 0.001006532 0.001039865 0.001169356 0.001392671 0.001934827 0.002180730 0.003615592 0.003879066 0.004314978 0.004980053 0.005928010 0.006384702 0.006725600 0.008614836 0.012624432 0.013913925 0.014637058 0.015404991 0.017719483 0.021863962 0.024457487 0.028166360 0.030219232 0.032440413 0.032925803 0.033375156 0.036135224 0.039348235 0.041187424 0.044264167 0.044649076 0.046178167 0.046970789 0.047765741 0.052053882 0.053036115 0.053572218 0.053896533 0.055624050 0.056925364 0.058025557 0.059802282 0.064924998 0.067515595 0.070127361 0.070835945 0.073692789 0.075475077 0.076997643 0.078042542 0.080871901 0.081331649 0.084485754 0.091304002 0.096325803 0.099459657 0.102030487 0.106184732 0.110593764 0.111514525 0.112579400 0.115424081 0.117327457 0.127036680 0.128732824 0.131783693 0.135982282 0.139490332 0.142368640 0.144275309 0.151119027 0.162441107 0.166858288 0.169556347 0.172791268 0.179281081 0.184837663 0.197821064 0.205885229 0.206662951 0.216094472 0.225668509 0.236346855 0.239066948 0.274568774 0.290931846 0.311204250 0.351723763 0.370608221 0.397498479 0.429009347 0.470257646 0.522128077 0.532693768 0.599775021 0.607518621 0.618750266 0.628136077 0.704721315 0.758507548 0.760133850 0.764389053 0.768587380 0.773234296 0.777526769 0.788206147 0.793822047 0.796782786 0.799287372 0.801245326 0.812574972 0.838875321 0.841249517 0.843966318 0.847449659 0.851350129 0.862602086 0.879607732 0.893591167 0.902569071 0.907336862 0.915056117 0.923783810 0.924492029 0.934675119 1.057147150 1.082370686 1.279499017 11 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.7099,-.1103,2.1351;-6.2474,-1.0304,2.4234;-5.9933,.1219,1.0945;-6.0816,.7106,2.775;-4.1959,-.267,2.2681;-3.7022,.6332,1.861;-3.8556,-1.1126,1.6413;-3.7067,-.4773,3.7039;-4.0081,.3935,4.3146;-2.6021,-.4921,3.71;-4.2251,-1.7615,4.3451;-4.0415,-2.6263,3.6811;-5.3245,-1.7283,4.472;-3.6511,-2.1371,5.6859;-1.9808,-1.7752,7.5496;-1.5437,-2.7139,7.1627;-2.4685,-2.0661,8.499;-.8653,-.766,7.8177;-1.3042,.1831,8.1845;-.3663,-.5206,6.8619;.1605,-1.2682,8.8332;.646,-2.1811,8.4366;-.3733,-1.5806,9.7501;1.2357,-.2459,9.2117;1.8667,-.6789,10.0092;.7495,.6434,9.6566;2.1296,.1911,8.0516;1.5613,.733,7.2752;2.9325,.8626,8.4011;2.6078,-.6811,7.5691;-3.9384,-3.3261,6.1035;-4.3253,-3.165,7.1516;-2.9986,-1.2554,6.5502;-2.8241,-.2428,6.1771;-4.2356,1.914,7.1828;-3.1436,1.9363,7.3478;-4.5767,2.954,7.0426;-4.4218,1.3772,6.2374;-4.9612,1.261,8.3563;-4.8649,1.9121,9.2431;-6.0441,1.2137,8.1358;-4.472,-.133,8.7503;-5.0054,-.4552,9.6624;-3.4042,-.1162,9.0267;-4.7474,-1.2389,7.7426;-4.7698,-2.4394,8.1617;-5.4671,-.9487,6.9424; -739.260744487156 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000584463634 0.000107339069 0.031244838423 0.008089499751 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.135512971 -0.000080353 0.000080905 0.000153007 0.000272613 0.000409474 0.000590089 0.001009393 0.001072047 0.001169429 0.001393865 0.001934919 0.002180687 0.003615700 0.003879112 0.004314914 0.004980043 0.005928127 0.006384900 0.006725543 0.008614528 0.012625109 0.013914343 0.014637018 0.015405022 0.017720117 0.021863820 0.024457702 0.028166362 0.030219498 0.032440429 0.032925767 0.033375151 0.036135388 0.039348327 0.041187290 0.044264121 0.044649385 0.046178116 0.046970798 0.047765516 0.052053834 0.053037326 0.053572113 0.053896633 0.055624009 0.056925736 0.058025481 0.059802398 0.064937974 0.067516198 0.070129115 0.070847814 0.073692834 0.075477957 0.076998983 0.078042881 0.080872042 0.081331574 0.084485724 0.091303972 0.096326725 0.099459663 0.102030485 0.106185467 0.110593616 0.111514902 0.112583430 0.115424016 0.117327745 0.127036790 0.128732694 0.131783504 0.135982501 0.139490202 0.142369473 0.144290524 0.151122358 0.162444471 0.166858302 0.169556304 0.172794441 0.179281351 0.184837711 0.197833554 0.205885055 0.206674961 0.216098139 0.225689388 0.236398626 0.239078476 0.274583111 0.290936781 0.311215374 0.351723859 0.370616835 0.397498635 0.429012572 0.470258058 0.522128903 0.532695778 0.599776735 0.607519353 0.618750409 0.628136923 0.704721329 0.758508544 0.760133923 0.764389025 0.768587500 0.773241475 0.777526764 0.788206390 0.793822124 0.796782707 0.799298641 0.801249364 0.812574957 0.838877812 0.841251440 0.843967316 0.847466092 0.851352307 0.862602137 0.879670846 0.893591229 0.902577048 0.907345583 0.915057426 0.923783916 0.924500548 0.934677187 1.057149386 1.082375524 1.279502119 12 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.723,-.1209,2.1359;-6.253,-1.0462,2.4221;-6.0089,.1118,1.096;-6.101,.6954,2.778;-4.2076,-.2656,2.2677;-3.7214,.6397,1.8622;-3.8607,-1.1069,1.6387;-3.7157,-.4754,3.7026;-4.0241,.3914,4.3156;-2.6108,-.4809,3.7079;-4.2231,-1.7655,4.341;-4.0306,-2.6276,3.6758;-5.3231,-1.7429,4.4662;-3.6487,-2.139,5.6822;-1.9793,-1.7765,7.5464;-1.5396,-2.7135,7.1584;-2.4692,-2.0704,8.4938;-.8658,-.7663,7.8198;-1.306,.181,8.1885;-.3653,-.5173,6.866;.1584,-1.2706,8.8352;.6453,-2.1812,8.4361;-.3765,-1.5872,9.7498;1.232,-.2485,9.2195;1.8643,-.6856,10.0125;.7457,.6366,9.671;2.1229,.1985,8.0621;1.5536,.7471,7.2927;2.927,.8669,8.4149;2.5982,-.6693,7.5712;-3.9364,-3.3273,6.1014;-4.3255,-3.164,7.1487;-2.9957,-1.2564,6.5455;-2.8199,-.2445,6.1711;-4.2118,1.9187,7.1851;-3.1208,1.9333,7.3575;-4.5454,2.9614,7.0471;-4.3951,1.3873,6.2362;-4.9494,1.2653,8.3512;-4.8568,1.9136,9.2404;-6.0309,1.2237,8.1225;-4.4698,-.1319,8.7459;-5.0097,-.4518,9.655;-3.4034,-.1214,9.0281;-4.7458,-1.2365,7.7372;-4.7709,-2.4369,8.1565;-5.464,-.9446,6.9362; -739.260742624644 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000754999866 0.000149295362 0.030587344213 0.007990883875 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.135513010 -0.000043207 0.000080891 0.000152709 0.000272009 0.000422274 0.000595389 0.001011355 0.001121784 0.001172401 0.001395359 0.001935005 0.002180796 0.003616133 0.003879031 0.004314870 0.004980015 0.005928292 0.006384724 0.006725430 0.008614431 0.012626953 0.013914632 0.014636903 0.015405163 0.017721361 0.021863544 0.024457723 0.028166316 0.030219590 0.032440426 0.032925863 0.033375097 0.036135388 0.039349191 0.041187375 0.044264069 0.044649508 0.046178213 0.046970870 0.047765231 0.052053700 0.053037709 0.053571990 0.053896602 0.055624062 0.056926336 0.058025615 0.059803560 0.064951633 0.067517527 0.070134468 0.070859033 0.073692807 0.075483343 0.077002819 0.078043009 0.080872465 0.081331624 0.084485739 0.091303899 0.096328142 0.099459730 0.102030534 0.106185284 0.110593720 0.111514903 0.112586949 0.115423612 0.117328016 0.127036783 0.128732621 0.131783213 0.135982689 0.139489908 0.142375116 0.144299399 0.151124805 0.162449019 0.166858451 0.169556189 0.172796845 0.179281318 0.184837735 0.197850904 0.205888579 0.206692161 0.216095803 0.225699010 0.236498194 0.239084869 0.274607028 0.290938957 0.311225944 0.351724849 0.370638418 0.397499660 0.429020238 0.470258513 0.522129360 0.532696481 0.599784335 0.607520714 0.618751610 0.628141378 0.704722764 0.758508569 0.760134641 0.764390017 0.768587561 0.773248987 0.777526976 0.788206542 0.793822319 0.796784676 0.799317501 0.801254293 0.812575056 0.838879435 0.841252614 0.843967321 0.847490617 0.851352216 0.862604726 0.879726247 0.893590990 0.902579353 0.907355505 0.915067680 0.923784114 0.924507818 0.934679279 1.057149695 1.082378431 1.279502936 13 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.7083,-.1114,2.1342;-6.2458,-1.0315,2.4225;-5.9911,.1204,1.0933;-6.0807,.7097,2.7735;-4.1944,-.2676,2.2683;-3.7006,.6327,1.8612;-3.8534,-1.1132,1.642;-3.7061,-.4773,3.7045;-4.0081,.3936,4.3147;-2.6015,-.4917,3.7114;-4.2245,-1.7615,4.3457;-4.0404,-2.6264,3.682;-5.324,-1.7286,4.472;-3.6512,-2.1368,5.6869;-1.9816,-1.775,7.5511;-1.5447,-2.7137,7.1642;-2.4695,-2.0657,8.5004;-.8657,-.7661,7.8192;-1.3037,.1823,8.1883;-.3682,-.5191,6.8632;.1617,-1.2704,8.8317;.6463,-2.1821,8.4321;-.3704,-1.5852,9.7487;1.2376,-.2489,9.2108;1.8715,-.685,10.0037;.7531,.638,9.6615;2.1266,.194,8.0499;1.5558,.7405,7.2795;2.9316,.863,8.3994;2.6012,-.6757,7.5606;-3.9389,-3.3257,6.1046;-4.326,-3.1645,7.1526;-2.9991,-1.255,6.5514;-2.8242,-.2424,6.1782;-4.2353,1.9144,7.1826;-3.1434,1.9363,7.3483;-4.576,2.9544,7.042;-4.4211,1.3774,6.2373;-4.9619,1.2618,8.3559;-4.866,1.9133,9.2425;-6.0446,1.2147,8.1347;-4.4732,-.1321,8.7506;-5.0072,-.4539,9.6625;-3.4056,-.1154,9.0277;-4.7481,-1.2383,7.7432;-4.7707,-2.4387,8.1626;-5.4676,-.9482,6.9427; -739.260745383687 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000146938913 0.000031550032 0.023407031414 0.008577884636 0.000300000000 0.000200000000 0.003062497140 0.002041664760 -0.135513259 -0.000082623 0.000037888 0.000110480 0.000253644 0.000362491 0.000595308 0.001012547 0.001146988 0.001185539 0.001405716 0.001935355 0.002181125 0.003616495 0.003878644 0.004314529 0.004980071 0.005928642 0.006385026 0.006725456 0.008614262 0.012629683 0.013915643 0.014637016 0.015405253 0.017723127 0.021864022 0.024457745 0.028166346 0.030219962 0.032440410 0.032925980 0.033375253 0.036135559 0.039350270 0.041187976 0.044264165 0.044649331 0.046178429 0.046971158 0.047765725 0.052053864 0.053038780 0.053572662 0.053896937 0.055624546 0.056928002 0.058025864 0.059805643 0.064974939 0.067519165 0.070142074 0.070882309 0.073692980 0.075493533 0.077008652 0.078043400 0.080873540 0.081331718 0.084486100 0.091304053 0.096330823 0.099459828 0.102030586 0.106185481 0.110594191 0.111515264 0.112592859 0.115423952 0.117328481 0.127036960 0.128732874 0.131783639 0.135983395 0.139490337 0.142381600 0.144316166 0.151130090 0.162455737 0.166858553 0.169556680 0.172800804 0.179282015 0.184838283 0.197876177 0.205891723 0.206721735 0.216102614 0.225728185 0.236613432 0.239109141 0.274634438 0.290948257 0.311250069 0.351725671 0.370664051 0.397500332 0.429029474 0.470259190 0.522130571 0.532698087 0.599790774 0.607522479 0.618752674 0.628145653 0.704724091 0.758508530 0.760135222 0.764390945 0.768587614 0.773257784 0.777527098 0.788207209 0.793822494 0.796786460 0.799336318 0.801259601 0.812575204 0.838881187 0.841254891 0.843968121 0.847513113 0.851354861 0.862606881 0.879789490 0.893591478 0.902583687 0.907366049 0.915075301 0.923785565 0.924515389 0.934682207 1.057150095 1.082381074 1.279503326 14 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.7021,-.1243,2.1224;-6.2347,-1.0487,2.4063;-5.9779,.1052,1.0793;-6.086,.6941,2.7583;-4.1883,-.2689,2.2691;-3.6979,.635,1.8659;-3.8358,-1.1122,1.646;-3.7102,-.4748,3.7089;-4.0211,.3951,4.3162;-2.6057,-.4837,3.724;-4.2272,-1.7611,4.3471;-4.0376,-2.6249,3.6835;-5.3272,-1.7318,4.4692;-3.6571,-2.1357,5.6897;-1.9864,-1.7765,7.5528;-1.5516,-2.7159,7.1653;-2.4734,-2.0664,8.5028;-.8687,-.7694,7.8192;-1.3044,.1768,8.1966;-.3775,-.5169,6.8614;.1657,-1.2795,8.8214;.6533,-2.1843,8.4093;-.3603,-1.6072,9.7374;1.2378,-.2561,9.2069;1.8796,-.6982,9.9907;.7497,.6218,9.6722;2.1169,.2077,8.0458;1.5372,.7595,7.2849;2.9189,.8787,8.3997;2.5963,-.6523,7.5422;-3.9469,-3.3241,6.1077;-4.333,-3.1624,7.1552;-3.004,-1.2545,6.5544;-2.8277,-.2424,6.181;-4.2217,1.9191,7.1913;-3.1304,1.9352,7.3619;-4.5566,2.9612,7.0522;-4.4058,1.3859,6.2435;-4.9566,1.2668,8.3595;-4.8626,1.9163,9.2478;-6.0385,1.2243,8.133;-4.4753,-.1297,8.7546;-5.0133,-.4492,9.6649;-3.4083,-.1182,9.0346;-4.7526,-1.2351,7.7467;-4.7771,-2.4354,8.1659;-5.4716,-.9432,6.9466; -739.260742099807 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000549113444 0.000142291301 0.028273604085 0.008387610762 0.000300000000 0.000200000000 0.001500000000 0.001000000000 -0.135513156 0.000012399 0.000074531 0.000136910 0.000267402 0.000364757 0.000595378 0.001015412 0.001153366 0.001205848 0.001410613 0.001935640 0.002182491 0.003617081 0.003878708 0.004314685 0.004980120 0.005929027 0.006385538 0.006726199 0.008614364 0.012631580 0.013916126 0.014637196 0.015405585 0.017725629 0.021864335 0.024457746 0.028166489 0.030220222 0.032440415 0.032926167 0.033375276 0.036135604 0.039351007 0.041187936 0.044264351 0.044649560 0.046178417 0.046971199 0.047765992 0.052053757 0.053038821 0.053574283 0.053897004 0.055624813 0.056932254 0.058027440 0.059805662 0.064979337 0.067519908 0.070141499 0.070886752 0.073693178 0.075500093 0.077011956 0.078043476 0.080873520 0.081335379 0.084486513 0.091304062 0.096332019 0.099459867 0.102030577 0.106185458 0.110595059 0.111515981 0.112593060 0.115424025 0.117328526 0.127038254 0.128733597 0.131783425 0.135983575 0.139490267 0.142381562 0.144316150 0.151131615 0.162461987 0.166858621 0.169556826 0.172801603 0.179282156 0.184838236 0.197900949 0.205891661 0.206746154 0.216099854 0.225745394 0.236663348 0.239117782 0.274644732 0.290961733 0.311272802 0.351728177 0.370706481 0.397500485 0.429042185 0.470259705 0.522131984 0.532698729 0.599797268 0.607524934 0.618753577 0.628147187 0.704724251 0.758522147 0.760139031 0.764392196 0.768587511 0.773263579 0.777527134 0.788207303 0.793822738 0.796786513 0.799353155 0.801263548 0.812575316 0.838884791 0.841255361 0.843968628 0.847513854 0.851355927 0.862614935 0.879804343 0.893591818 0.902591902 0.907375728 0.915076194 0.923786821 0.924525522 0.934682255 1.057156758 1.082382254 1.279505377 15 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.7017,-.1119,2.1306;-6.2394,-1.0322,2.4179;-5.9815,.1192,1.0888;-6.0763,.7094,2.7683;-4.1881,-.2673,2.2691;-3.6935,.6331,1.8629;-3.8448,-1.1131,1.6443;-3.7038,-.4762,3.7067;-4.0071,.3954,4.3155;-2.5991,-.4909,3.7165;-4.2242,-1.7599,4.3474;-4.04,-2.6251,3.6842;-5.3239,-1.726,4.4723;-3.6526,-2.1355,5.6892;-1.9835,-1.7741,7.5539;-1.5481,-2.7138,7.1676;-2.4708,-2.0632,8.504;-.8663,-.7661,7.8197;-1.3029,.1824,8.19;-.371,-.5193,6.8625;.1633,-1.2714,8.8294;.6466,-2.1832,8.4282;-.3665,-1.5863,9.7476;1.2407,-.2506,9.2061;1.8766,-.6873,9.9973;.7576,.6364,9.6584;2.1269,.1924,8.0429;1.5542,.7394,7.274;2.933,.861,8.3906;2.6002,-.6773,7.552;-3.9407,-3.3245,6.1063;-4.3274,-3.164,7.1543;-3.0012,-1.2539,6.5545;-2.8265,-.2411,6.1818;-4.2424,1.9141,7.1839;-3.1503,1.938,7.3484;-4.5849,2.9534,7.0426;-4.4283,1.3759,6.2393;-4.9665,1.2615,8.3586;-4.8702,1.9135,9.2447;-6.0495,1.2129,8.1389;-4.4756,-.1318,8.7532;-5.0082,-.4541,9.6657;-3.4077,-.1135,9.0291;-4.7501,-1.2382,7.7459;-4.7721,-2.4386,8.1651;-5.4697,-.9484,6.9454; -739.260745550304 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000121583107 0.000029882777 0.032046117629 0.008267749583 0.000300000000 0.000200000000 0.003701172081 0.002467448054 -0.135513222 0.000007347 0.000100289 0.000134972 0.000266088 0.000368397 0.000594470 0.001015379 0.001155545 0.001217781 0.001410781 0.001935074 0.002182333 0.003617302 0.003878878 0.004314949 0.004980734 0.005929178 0.006385559 0.006726239 0.008613916 0.012632072 0.013916273 0.014637225 0.015405537 0.017726275 0.021864605 0.024457854 0.028166391 0.030220030 0.032440412 0.032926170 0.033375512 0.036135546 0.039351654 0.041189251 0.044264315 0.044649528 0.046178467 0.046971254 0.047766423 0.052053962 0.053041188 0.053574522 0.053897063 0.055624878 0.056934901 0.058028065 0.059806831 0.064981144 0.067520139 0.070144435 0.070889003 0.073693323 0.075501542 0.077015024 0.078043570 0.080875117 0.081334640 0.084486759 0.091304147 0.096332413 0.099459890 0.102030609 0.106185790 0.110595192 0.111516520 0.112594006 0.115424634 0.117328552 0.127038146 0.128733548 0.131783729 0.135983567 0.139490876 0.142383567 0.144318980 0.151132201 0.162463809 0.166858673 0.169556879 0.172802079 0.179282150 0.184838458 0.197907963 0.205892390 0.206751882 0.216103640 0.225749398 0.236681071 0.239119772 0.274651305 0.290964506 0.311278129 0.351728678 0.370716747 0.397500573 0.429044780 0.470259707 0.522132340 0.532699451 0.599800891 0.607525478 0.618754402 0.628151719 0.704731627 0.758525117 0.760140341 0.764394948 0.768587690 0.773264808 0.777527423 0.788207182 0.793822709 0.796788811 0.799356591 0.801264391 0.812575552 0.838885641 0.841255787 0.843972119 0.847514918 0.851364475 0.862618579 0.879810845 0.893592398 0.902599041 0.907375973 0.915076639 0.923788197 0.924527455 0.934683347 1.057158609 1.082382834 1.279505913 16 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.6901,-.0982,2.1336;-6.2381,-1.0109,2.4254;-5.9699,.1323,1.0916;-6.0532,.7296,2.7696;-4.1781,-.271,2.2689;-3.6739,.6219,1.8588;-3.8466,-1.1228,1.6458;-3.6929,-.4807,3.7062;-3.9849,.3959,4.3131;-2.5884,-.5078,3.7139;-4.2259,-1.7566,4.3519;-4.0537,-2.6253,3.6903;-5.3246,-1.7094,4.4802;-3.6538,-2.1341,5.693;-1.9841,-1.7727,7.5575;-1.5505,-2.7136,7.1719;-2.4699,-2.0597,8.509;-.8651,-.7656,7.8197;-1.3,.1836,8.1904;-.372,-.52,6.8611;.1664,-1.2711,8.8272;.6476,-2.1838,8.4254;-.3616,-1.5848,9.747;1.2461,-.2513,9.2007;1.8831,-.6881,9.9908;.7652,.6367,9.6534;2.1304,.1895,8.0351;1.5568,.7367,7.2669;2.9383,.8574,8.3807;2.6015,-.6812,7.5436;-3.9412,-3.3236,6.109;-4.3261,-3.1648,7.1578;-3.0026,-1.2528,6.559;-2.829,-.2395,6.1871;-4.2666,1.909,7.1776;-3.1737,1.9409,7.3345;-4.617,2.9453,7.0331;-4.4556,1.3644,6.2371;-4.9786,1.2577,8.3605;-4.8788,1.9135,9.2434;-6.063,1.2029,8.1491;-4.4778,-.1319,8.7559;-5.0043,-.4559,9.6713;-3.4086,-.1066,9.0265;-4.7508,-1.2404,7.7503;-4.77,-2.4406,8.1703;-5.4717,-.953,6.9502; -739.260744983951 0.000000000000 Maximum Force|RMS Force|Maximum Displacement|RMS Displacement 0.000229901502 0.000058010834 0.023052420735 0.005936152542 0.000300000000 0.000200000000 0.001957359982 0.001304906655 -0.135513274 0.000038976 0.000101883 0.000129578 0.000251641 0.000371141 0.000597981 0.001022571 0.001157178 0.001219372 0.001411060 0.001935122 0.002182593 0.003617661 0.003877398 0.004312920 0.004979518 0.005929179 0.006385034 0.006726422 0.008613550 0.012632662 0.013916308 0.014637378 0.015405711 0.017727338 0.021865606 0.024457940 0.028166698 0.030220207 0.032440357 0.032926171 0.033375611 0.036135649 0.039353231 0.041194313 0.044264366 0.044649545 0.046178554 0.046971333 0.047767328 0.052054040 0.053041490 0.053574657 0.053897690 0.055626526 0.056936071 0.058036462 0.059804968 0.064982542 0.067520133 0.070154933 0.070889256 0.073693050 0.075501552 0.077020513 0.078043520 0.080881032 0.081337028 0.084486636 0.091304077 0.096332478 0.099459821 0.102030517 0.106186170 0.110595446 0.111517123 0.112594088 0.115425277 0.117328558 0.127039162 0.128733768 0.131784132 0.135983643 0.139491697 0.142393348 0.144319928 0.151132793 0.162463753 0.166858522 0.169557367 0.172801940 0.179281788 0.184838000 0.197906045 0.205891874 0.206754113 0.216106823 0.225747027 0.236679835 0.239120704 0.274652990 0.290963519 0.311279139 0.351729687 0.370721478 0.397499766 0.429045263 0.470259645 0.522132372 0.532700284 0.599804679 0.607525985 0.618755853 0.628159878 0.704748720 0.758528075 0.760142205 0.764400451 0.768587606 0.773264439 0.777528225 0.788207353 0.793822779 0.796789279 0.799358351 0.801264458 0.812576347 0.838886596 0.841255923 0.843976716 0.847515269 0.851375057 0.862620721 0.879813870 0.893592650 0.902606970 0.907376116 0.915074730 0.923798397 0.924528112 0.934683610 1.057158890 1.082383900 1.279505748 6 1 1 1 6 1 1 6 1 1 6 1 1 6 6 1 1 6 1 1 6 1 1 6 1 1 6 1 1 1 8 1 6 1 6 1 1 1 6 1 1 6 1 1 6 8 1 212.15929999999994 AuxInfo=1/0/N:27,1,35,24,5,39,21,8,42,18,15,11,33,45,14,46,31,32/CRV:13.3,14.3,15.3,18.2/rA:47nCHHHCHHCHHCHHC3CHHCHHCHHCHHCHHHOH2C3HCHHHCHHCHHC3OH/rB:s1;s1;s1;s1;s5;s5;s5;s8;s8;s8;s11;s11;s11;;s15;s15;s15;s18;s18;s18;s21;s21;s21;s24;s24;s24;s27;s27;s27;s14;s31;s14s15;s33;;s35;s35;s35;s35;s39;s39;s39;s42;s42;s42;s32s45;s45;/rC:-5.6993,-.107,2.1325;-6.2404,-1.0246,2.4216;-5.9798,.1241,1.0909;-6.0696,.7165,2.77;-4.1862,-.2683,2.269;-3.6886,.6296,1.8613;-3.8473,-1.116,1.6444;-3.7007,-.4778,3.7062;-4.0002,.3952,4.3147;-2.5961,-.4963,3.7146;-4.2247,-1.7592,4.3485;-4.0442,-2.6254,3.6857;-5.324,-1.7214,4.4747;-3.6526,-2.1354,5.6899;-1.9832,-1.7738,7.5545;-1.5481,-2.7137,7.1684;-2.4702,-2.0625,8.505;-.8657,-.7659,7.8196;-1.3022,.183,8.1893;-.3705,-.5197,6.8622;.1638,-1.2707,8.8296;.6466,-2.1831,8.429;-.3661,-1.5845,9.7481;1.2418,-.2501,9.2052;1.8774,-.6863,9.9968;.7592,.6376,9.6566;2.1282,.1912,8.0416;1.5559,.7378,7.2721;2.9348,.8597,8.3886;2.601,-.6793,7.5515;-3.9403,-3.3245,6.1068;-4.3266,-3.1645,7.155;-3.0011,-1.2538,6.5553;-2.8268,-.2409,6.1828;-4.2491,1.9123,7.1814;-3.1568,1.9385,7.3436;-4.5939,2.9507,7.0392;-4.436,1.3721,6.2381;-4.9697,1.2601,8.3586;-4.8722,1.9133,9.2437;-6.053,1.2097,8.1414;-4.4758,-.132,8.7535;-5.0067,-.4548,9.6668;-3.4076,-.1117,9.0278;-4.7498,-1.2391,7.7467;-4.7711,-2.4394,8.1662;-5.4698,-.95,6.9463; -739.260745684348 0 FORWARD BACKWARD 0 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 73 74 75 76 77 78 79 80 81 82 83 84 85 86 87 88 89 90 91 92 93 94 95 96 97 98 99 100 101 102 103 104 105 106 107 108 109 110 111 112 113 114 115 116 117 118 119 120 121 122 123 124 125 126 127 128 129 130 131 132 133 134 -930.97572857 17.77912287 30.86935075 31.48169504 45.95654993 49.10057395 73.58597151 93.39343340 107.10737435 121.80847530 122.50326709 133.39753594 154.38183356 165.48581963 189.90691376 215.51528062 231.08117037 246.46334689 272.18064560 289.10201830 301.43417621 307.31054710 333.26855764 353.86266902 394.60778677 427.73865261 439.10775105 465.90673911 490.39037001 522.94885230 584.31148129 608.12822444 651.44561246 745.79347426 759.67077488 772.06518027 777.48229786 785.41909062 828.51928366 849.85179692 858.08435449 900.65944801 903.25311616 914.25655476 916.56511069 955.53177862 975.16724291 1000.81883550 1005.24670976 1010.01022189 1030.78422019 1048.07583121 1071.53209181 1096.04852312 1110.04944815 1117.64671284 1119.02126404 1127.55877991 1135.18720345 1142.95226430 1146.95412942 1160.08577124 1166.81263154 1201.30374492 1226.99305714 1241.36913793 1249.02941790 1269.82940871 1283.75135578 1296.53307891 1308.39919710 1310.53478108 1324.44403525 1332.41180368 1337.69534943 1346.51482942 1366.03327464 1383.03666972 1392.15162777 1393.73081696 1396.21621102 1404.39021988 1424.01365841 1428.95919029 1429.95500099 1431.97700691 1438.37494502 1452.02610754 1461.74582048 1481.11191362 1484.67464427 1486.54012564 1487.38437000 1489.00068983 1494.38337683 1496.13890822 1496.89332744 1497.98159055 1502.29160564 1503.10960207 1504.23312756 1509.43389652 1543.55987154 1630.42627815 1681.01116778 1859.23385755 2953.08148399 3017.87254475 3024.27457690 3028.75694503 3028.87349819 3030.72732841 3031.45972781 3035.59711526 3036.16539672 3036.84437820 3038.52845578 3042.53855127 3058.47863673 3063.42474395 3075.23284739 3080.12980918 3081.70870831 3086.62639324 3089.03362718 3090.80536371 3101.39165851 3116.30586956 3119.28234089 3120.42258980 3125.26462869 3126.88122590 3129.16979267 3136.11879699 3216.07859407 1.87525300 3.33199832 2.99196549 2.57672539 2.75405391 2.89036451 2.52656919 3.48607189 2.48160034 2.14886704 2.32942844 2.86171510 2.19595351 2.39248558 2.42638031 1.94983260 2.25674226 1.73694501 1.42886385 1.77934054 2.28211547 1.32277548 2.49987438 3.16367865 3.32305832 2.31415297 2.68028169 3.03808783 2.46267215 2.98691753 4.47849242 2.47734436 3.32452536 1.11631893 1.62106913 1.24854222 1.39040088 1.24308680 1.70398494 1.41824619 1.58337778 1.99622972 1.98358735 1.71508117 1.40089496 2.88141157 1.45828642 1.80877129 1.45666763 1.64119809 1.73432799 1.28547012 2.79014277 1.97953217 2.17574098 2.07037689 1.80217249 1.97490637 1.68998896 1.83524196 1.86016371 1.99734804 1.51013125 1.57717666 1.42383766 1.39927174 1.34595710 1.26701105 1.33819093 1.30005566 1.22448265 1.22869849 1.16419461 1.16830202 1.08054167 1.21797345 1.23122209 1.40381499 1.32901155 1.35009911 1.39600007 1.45841041 1.63207581 1.41190530 1.40508203 1.34749573 1.67761034 1.15239508 1.08562205 1.08202715 1.07266486 1.07351330 1.07385878 1.07559162 1.05276074 1.07486479 1.06768060 1.07136719 1.07428263 1.06279381 1.05389231 1.09751939 3.12946502 5.68088330 2.26999938 1.21969129 1.08746802 1.06391601 1.06288402 1.04768244 1.04220207 1.06241190 1.05567410 1.04052239 1.06351642 1.06206997 1.06501283 1.06322406 1.06748205 1.09963834 1.10295145 1.10027010 1.10375668 1.10300858 1.10237299 1.10460627 1.10468138 1.10040923 1.10429177 1.10428835 1.10450645 1.10425242 1.10424935 1.10369072 1.08854145 0.0005280770 -0.0001439513 -0.0001550724 0.0001913676 0.0001072601 -0.0002884699 0.0007568299 0.0002717106 -0.0006792137 -0.0001501392 0.0001908265 0.0003061781 0.0004698613 0.0005289525 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