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© September 2007; August 2010 Lorentz JÄNTSCHI && Sorana Daniela BOLBOACĂ

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forcefield mm+
sys 0 0 1
view 40 0.18707 61.15 21.15 0.06796612 -0.7806716 -0.6212347 0.5800993 0.5375221 -0.6120089 0.8117053 -0.3187819 0.4894003 1.4 -0.28178 -60.761
seed 0
mol 1
atom 1 - C ** - -0.1865859 -0.4017 -1.9863 -2.5586 3 2 d 6 s 7 s
atom 2 - C ** - -0.1653547 -0.3734 -0.5418 -2.9984 3 1 d 3 s 16 s
atom 3 - C ** - 0.07313299 1.5507 -0.0893999 -3.3802 4 2 s 4 s 23 s 24 s
atom 4 - C ** - 0.07256889 2.5029 -0.2597 -1.7479 4 3 s 5 s 8 s 19 s
atom 5 - C ** - -0.1155519 3.0308 -1.7155 -2.1107 2 4 s 6 s
atom 6 - C ** - 0.2844877 1.3968 -2.6468 -2.3386 3 1 s 5 s 41 d
atom 7 - C ** - 0.007225037 -2.1344 -2.676 -2.1346 1 1 s
atom 8 - C ** - 0.1191769 1.1704 -0.2872 -0.3741 3 4 s 9 s 25 s
atom 9 - C ** - 0.02907777 0.1999 1.3239 0.4011 3 8 s 10 s 14 s
atom 10 - C ** - 0.04063988 0.4201 1.3349 2.3186 4 9 s 11 s 17 s 34 s
atom 11 - C ** - 0.015275 0.4271 2.7934 3.0491 3 10 s 12 s 18 s
atom 12 - C ** - -0.06627703 -0.6565 3.9365 2.264 2 11 s 13 s
atom 13 - C ** - 0.1327987 -2.1031 2.7707 1.6588 3 12 s 14 s 20 s
atom 14 - C ** - -0.02573061 -1.609999 1.4222 0.243 4 9 s 13 s 15 s 42 s
atom 15 - C ** - 0.09446526 -2.2714 1.7985 -1.383 3 14 s 16 s 22 s
atom 16 - C ** - 0.2163863 -2.1967 0.4511 -2.7565 3 2 s 15 s 21 s
atom 17 - C ** - 0.04063058 2.059 1.2743 2.6205 2 10 s 18 s
atom 18 - O ** - -0.2884259 1.9987 2.86 2.7588 2 11 s 17 s
atom 19 - O ** - -0.3224783 3.6797 0.7339 -1.4301 1 4 s
atom 20 - O ** - -0.3570738 -3.3915 3.5704 1.283399 1 13 s
atom 21 - O ** - -0.4246879 -3.0108 0.8971 -4.2297 2 16 s 38 s
atom 22 - O ** - -0.3312092 -1.7054 3.0449 -1.8075 1 15 s
atom 23 - C ** - -0.10987 1.5059 1.7086 -3.5887 1 3 s
atom 24 - C ** - -0.03476286 2.3713 -1.6115 -4.7547 1 3 s
atom 25 - O ** - -0.4080491 1.6755 -1.2364 0.84 2 8 s 26 s
atom 26 - C ** - 0.4025817 0.9599 -2.1705 1.8275 3 25 s 27 s 33 d
atom 27 - C ** - 0.01776743 1.6791 -2.53 3.3854 3 26 s 28 d 32 s
atom 28 - C ** - -0.07276154 0.5515 -2.5516 4.4745 2 27 d 29 s
atom 29 - C ** - -0.1171894 0.8834 -2.9868 5.6905 2 28 s 30 d
atom 30 - C ** - -0.08489799 2.1714 -3.4978 5.7533 2 29 d 31 s
atom 31 - C ** - -0.1224713 3.1215 -3.2003 4.6899 2 30 s 32 d
atom 32 - C ** - -0.08231306 2.7785 -2.5684 3.5719 2 27 s 31 d
atom 33 - O ** - -0.3467989 -0.0718 -2.7436 1.4371 1 26 d
atom 34 - O ** - -0.3377938 -0.5656 0.3452 3.1476 2 10 s 35 s
atom 35 - C ** - 0.3309395 -1.2137 0.6334 4.6552 3 34 s 36 s 37 d
atom 36 - C ** - -0.0358696 -2.786699 0.7361 5.3269 1 35 s
atom 37 - O ** - -0.3224678 -0.3628 0.7184 5.5325 1 35 d
atom 38 - C ** - 0.3225954 -3.9093 -0.0779 -5.379 3 21 s 39 s 40 d
atom 39 - C ** - 0.04979205 -5.2395 -0.1175 -6.7476 1 38 s
atom 40 - O ** - -0.3116951 -3.4164 -1.168 -5.247 1 38 d
atom 41 - O ** - -0.3123288 1.527699 -3.8747 -2.3833 1 6 d
atom 42 - C ** - -0.1408381 -2.0324 -0.2956 0.369 1 14 s
endmol 1