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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 0.20026 55 15 1 0 0 0 1 0 0 0 1 -0.4307 -0.4641 -54.166
seed 0
mol 1
atom 1 - N ** - 0.2141485 3.047972 -1.433179 0.2127697 1 3 s
atom 2 - N ** - 0.1480465 -0.3961686 -0.8475609 -0.1905545 2 4 d 10 s
atom 3 - C ** - -0.2436037 1.837517 -0.8146518 -0.03934383 3 1 s 9 s 10 d
atom 4 - C ** - -0.7995949 -0.1993983 0.4825754 -0.2742006 3 2 d 5 s 9 s
atom 5 - S ** - 2.287279 -1.571815 1.63583 -0.3639914 4 4 s 6 d 7 d 8 s
atom 6 - O ** - -0.8084898 -1.530958 2.544231 0.7594899 1 5 d
atom 7 - O ** - -0.8209543 -2.809613 0.9624081 -0.6719971 1 5 d
atom 8 - N ** - -0.4610744 -1.082033 2.564414 -1.771789 1 5 s
atom 9 - S ** - 0.3552179 1.509782 0.9032539 -0.1864597 2 3 s 4 s
atom 10 - N ** - -0.1745033 0.6907821 -1.576647 -0.07235357 2 2 s 3 d
endmol 1