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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 0.11919 61.6 21.6 -0.9511711 -0.2311993 -0.2045006 -0.04043628 0.7501593 -0.6600197 0.3060041 -0.6195224 -0.7228786 0.29948 0.60825 -58.284
seed 0
mol 1
atom 1 - C ** - -0.1403737 0.9825 -1.4644 3.7197 3 2 s 6 d 7 s
atom 2 - C ** - 0.163785 2.3794 -2.3433 3.9996 3 1 s 3 s 42 s
atom 3 - C ** - -0.1251779 3.7551 -1.5995 3.3353 2 2 s 4 s
atom 4 - C ** - -0.06719017 3.3137 -0.0337 2.9309 3 3 s 5 s 10 s
atom 5 - C ** - 0.02769375 2.6804 0.4454 4.4977 4 4 s 6 s 8 s 9 s
atom 6 - C ** - -0.1427832 0.8924 0.0382 3.9417 3 1 d 5 s 15 s
atom 7 - C ** - -0.07449722 -0.1657 -2.4458 3.0143 1 1 s
atom 8 - C ** - -0.09542274 3.4079 2.2211 4.3874 1 5 s
atom 9 - C ** - -0.01499748 3.4064 -0.7334 6.244 1 5 s
atom 10 - C ** - 0.2469087 2.0438 0.1639 1.1003 3 4 s 11 s 36 s
atom 11 - C ** - -0.03515196 1.2388 2.029799 0.5019 3 10 s 12 s 16 s
atom 12 - C ** - 0.007938385 -0.4347 2.6527 0.9823 4 11 s 13 s 14 s 19 s
atom 13 - C ** - -0.1629958 -1.679 1.6686 0.1773 1 12 s
atom 14 - C ** - 0.1681297 -0.6409 2.6763 2.764599 3 12 s 15 s 28 s
atom 15 - C ** - 0.3046584 -0.8298 0.9249 3.4744 3 6 s 14 s 32 s
atom 16 - C ** - -0.09344721 1.3506 2.1603 -1.3879 3 11 s 17 s 40 s
atom 17 - C ** - 0.1761317 1.242 3.8545 -1.8071 3 16 s 18 s 20 s
atom 18 - C ** - -0.06545067 -0.4575 4.6639 -1.4679 2 17 s 19 s
atom 19 - C ** - 0.1201391 -1.057 4.3087 0.2406 3 12 s 18 s 24 s
atom 20 - O ** - -0.4326291 1.9627 4.0114 -3.3909 2 17 s 21 s
atom 21 - C ** - 0.3500438 1.8791 3.589 -5.0613 3 20 s 22 s 23 d
atom 22 - C ** - -0.01092148 2.7001 2.7053 -6.3671 1 21 s
atom 23 - O ** - -0.3023052 0.9952 4.2277 -5.5664 1 21 d
atom 24 - O ** - -0.3560514 -1.027099 5.6148 1.2651 2 19 s 25 s
atom 25 - C ** - 0.3641784 -2.1979 6.8156 1.6154 3 24 s 26 s 27 d
atom 26 - C ** - -0.08880186 -3.8644 6.8391 1.8363 1 25 s
atom 27 - O ** - -0.3219724 -1.7369 7.9226 1.8814 1 25 d
atom 28 - O ** - -0.3870602 -1.8273 3.7781 3.1486 2 14 s 29 s
atom 29 - C ** - 0.3670883 -2.3217 4.6616 4.4166 3 28 s 30 s 31 d
atom 30 - C ** - -0.06579876 -2.3843 6.2887 4.8008 1 29 s
atom 31 - O ** - -0.3233571 -2.9047 3.9947 5.2487 1 29 d
atom 32 - O ** - -0.4462786 -2.0665 -0.1871 2.5256 2 15 s 33 s
atom 33 - C ** - 0.3321242 -3.8632 -0.6167 2.4241 3 32 s 34 s 35 d
atom 34 - C ** - -0.005043983 -5.0084 -1.9567 2.029799 1 33 s
atom 35 - O ** - -0.2971182 -4.5755 0.3019 2.7566 1 33 d
atom 36 - O ** - -0.456625 0.9048 -1.1761 0.9019 2 10 s 37 s
atom 37 - C ** - 0.4169679 -0.4875 -1.819999 0.1108 3 36 s 38 s 39 d
atom 38 - C ** - -0.04759502 -1.3648 -3.296 0.4792 1 37 s
atom 39 - O ** - -0.3428073 -1.0374 -1.1448 -0.7314 1 37 d
atom 40 - C ** - 0.1206818 0.2102 1.0519 -2.7858 2 16 s 41 s
atom 41 - O ** - -0.298748 -1.1102 1.4868 -2.7854 1 40 s
atom 42 - O ** - -0.3325224 2.1626 -3.6026 3.2593 2 2 s 43 s
atom 43 - C ** - 0.3752007 2.5379 -4.9685 3.5882 3 42 s 44 s 45 d
atom 44 - C ** - -0.09222889 1.4308 -6.0969 3.4476 1 43 s
atom 45 - O ** - -0.3474407 3.6917 -5.2488 3.8703 1 43 d
endmol 1