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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 0.099798 55 15 1 0 0 0 1 0 0 0 1 -0.0858 -0.01685 -54.742
seed -1111
mol 1
atom 1 - C ** - 0 -3.0893 0.4683 -0.0157 2 2 s 6 d
atom 2 - C ** - 0 -3.0621 1.799599 -0.0017 3 1 s 3 d 24 s
atom 3 - C ** - 0 -2.001799 2.3864 -0.0138 2 2 d 4 s
atom 4 - C ** - 0 -0.9307 1.5572 0.0114 2 3 s 5 d
atom 5 - C ** - 0 -0.9739 0.5791 -0.0073 3 4 d 6 s 7 s
atom 6 - C ** - 0 -2.2103 -0.1582 -0.0419 2 1 d 5 s
atom 7 - C ** - 0 0.8814 -0.9941 -0.5599 3 5 s 8 s 14 d
atom 8 - C ** - 0 0.9032 -1.3715 -0.5722 3 7 s 9 s 13 d
atom 9 - C ** - 0 1.8969 -3.0607 -0.5 2 8 s 10 d
atom 10 - C ** - 0 1.9261 -4.144199 -0.2732 2 9 d 11 s
atom 11 - C ** - 0 0.726 -4.695 -0.0735 3 10 s 12 d 25 s
atom 12 - C ** - 0 -0.5655 -3.7475 0.0233 2 11 d 13 s
atom 13 - C ** - 0 -0.2601 -0.3953 -0.092 2 8 d 12 s
atom 14 - C ** - 0 2.2511 0.4327 -0.0827 3 7 d 15 s 21 s
atom 15 - C ** - 0 2.3619 1.9968 0.0557 3 14 s 16 d 20 s
atom 16 - C ** - 0 3.2103 2.5694 0.0007 2 15 d 17 s
atom 17 - C ** - 0 3.0748 3.9457 -0.0057 2 16 s 18 d
atom 18 - C ** - 0 1.8595 4.641 0.0035 3 17 d 19 s 23 s
atom 19 - C ** - 0 0.8596 4.0412 -0.0229 2 18 s 20 d
atom 20 - C ** - 0 1.0152 2.9089 -0.0617 2 15 s 19 d
atom 21 - C ** - 0 3.4754 -0.3539 -0.0172 2 14 s 22 t
atom 22 - N ** - 0 4.4749 -0.8476 -0.0337 1 21 t
atom 23 - O ** - 0 1.8409 6.1822 0.0320999 1 18 s
atom 24 - O ** - 0 -4.3733 2.5714 -0.0015 1 2 s
atom 25 - O ** - 0 0.6885 -6.1634 -0.0077 1 11 s
endmol 1