Library Powered by BSD http://bsd.org/ FreeBSD http://freebsd.org/ MySQL http://mysql.com/ Apache http://apache.org/ PHP http://php.net/ PHP http://SourceForge.net/
© September 2007; August 2010 Lorentz JÄNTSCHI && Sorana Daniela BOLBOACĂ

up one level Up

forcefield mm+
sys 0 0 1
view 40 0.18471 55 15 -0.5754032 -0.3072742 0.7579537 0.1941167 0.8489511 0.4915289 -0.7944998 0.4299588 -0.4288421 1.0679 -0.3614 -54.968
seed 0
mol 1
atom 1 - C ** - -0.08370876 -1.041079 -1.05453 -0.1230759 2 3 s 6 s
atom 2 - C ** - -0.1130462 -2.509835 0.9366651 -0.4698398 1 3 s
atom 3 - C ** - -0.01111174 -1.240705 0.2289596 -0.9586336 3 1 s 2 s 4 s
atom 4 - C ** - -0.105114 0.2384112 2.088886 -2.006884 2 3 s 5 s
atom 5 - C ** - -0.04539061 2.405078 1.158739 -0.8273041 2 4 s 7 s
atom 6 - C ** - -0.2057266 0.2772137 -1.604934 0.4174427 2 1 s 7 s
atom 7 - N ** - -0.1017728 2.785287 -0.1441718 -0.2288305 3 5 s 6 s 8 s
atom 8 - C ** - -0.09348011 3.228988 -1.090281 -1.279113 2 7 s 9 s
atom 9 - C ** - 0.221312 2.320814 -1.111333 -2.497466 3 8 s 10 d 11 s
atom 10 - O ** - -0.3576322 2.430776 -1.897666 -3.425254 1 9 d
atom 11 - N ** - -0.02151155 1.229452 -0.2053785 -2.573907 2 9 s 12 s
atom 12 - C ** - -0.1315446 1.15918 0.9539678 -1.671595 3 11 s 13 d 16 s
atom 13 - N ** - -0.09832287 -0.1083886 1.168256 -0.8914865 2 12 d 14 s
atom 14 - N ** - 0.1231022 -0.3513791 2.399877 1.927063 2 13 s 15 d
atom 15 - C ** - -0.6009178 -0.446458 1.628458 2.78613 3 14 d 16 s 17 s
atom 16 - S ** - 0.04230452 1.750673 -0.7384756 1.057436 2 12 s 15 s
atom 17 - S ** - 2.372825 -0.5506686 0.5954388 4.178547 4 15 s 18 s 19 d 20 d
atom 18 - N ** - -0.4594927 -1.854091 -0.4611016 3.666964 2 17 s 21 s
atom 19 - O ** - -0.7845106 0.6237008 -0.1973264 4.354399 1 17 d
atom 20 - O ** - -0.8446379 -1.029107 1.398972 5.269803 1 17 d
atom 21 - H ** - 0.09982198 -2.324356 -0.9459566 4.406316 1 18 s
endmol 1