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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 0.32113 55 15 0.6563907 -0.1349225 0.7422581 -0.2150658 0.9095872 0.3555246 -0.7231168 -0.3929974 0.5680274 0.26769 0.07296 -54.795
seed 0
mol 1
atom 1 - O ** - -0.1706209 -0.9439784 0.480335 3.112226 1 11 s
atom 2 - O ** - -0.6004977 2.174427 -1.323408 1.20693 1 6 d
atom 3 - O ** - -0.5749125 1.298138 -0.7969555 3.060677 1 6 d
atom 4 - O ** - -0.5986495 -1.8426 0.7546026 -3.138469 1 7 d
atom 5 - O ** - -0.587956 0.08566438 -0.1229801 -3.108644 1 7 d
atom 6 - N ** - 1.32143 1.280815 -0.8038492 1.848867 3 2 d 3 d 8 s
atom 7 - N ** - 1.318331 -0.8779042 0.3345794 -2.532662 3 4 d 5 d 9 s
atom 8 - C ** - -0.4838676 0.1425868 -0.1650509 1.103405 3 6 s 10 s 11 d
atom 9 - C ** - -0.480072 -0.8860475 0.3826658 -1.031631 3 7 s 10 d 12 s
atom 10 - C ** - 0.120636 0.1524139 -0.1908434 -0.2988828 2 8 s 9 d
atom 11 - C ** - 0.2548599 -0.9403856 0.4603547 1.764381 3 1 s 8 d 13 s
atom 12 - C ** - 0.08740711 -1.956615 1.003193 -0.3633526 2 9 s 13 d
atom 13 - C ** - -0.2508259 -1.9853 1.038719 1.015056 2 11 s 12 d
endmol 1