IBS-ZINC06760769 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 32 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3790 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 -0.6820 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0210 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3810 1.4090 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 2.0870 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5860 2.1260 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8370 3.3030 -0.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0830 3.6120 -0.3820 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6370 2.7100 0.3440 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7920 1.7740 0.6140 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8620 4.1110 -1.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9840 5.2690 -0.3690 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9420 6.0580 -1.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8970 5.7990 -2.8400 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 7.4320 -0.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 6.5870 -3.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5490 7.3600 -2.5240 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 7.0340 -1.2930 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -2.1890 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0910 -2.6690 -0.0110 F 0 0 0 0 0 0 0 0 0 0 0 0 1.8770 -2.6420 -1.1720 F 0 0 0 0 0 0 0 0 0 0 0 0 1.8990 -2.6540 1.1120 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9060 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3370 -0.5090 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1540 3.1670 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 4.6680 -2.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1450 3.4420 -1.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2480 6.5870 -4.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 2 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 23 1 0 0 0 0 M END