IBS-ZINC02412400 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3750 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 1.2080 -0.6830 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 0.0150 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 1.3940 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1860 2.0870 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 3.5620 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2780 4.3670 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8250 5.6880 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4420 5.6360 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 4.3370 0.0180 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4300 6.7440 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7940 6.5480 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6790 7.6740 0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3820 8.5670 0.0780 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3440 5.1740 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0680 4.7080 1.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5790 3.4270 1.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3740 2.6030 0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6570 3.0600 -1.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1460 4.3420 -1.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0200 0.9920 0.0440 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 -2.4450 -0.0230 S 0 0 0 0 0 0 0 0 0 0 0 0 2.4800 -2.8390 0.5080 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0190 -2.8590 0.5310 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2110 -2.9270 -1.6070 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.9040 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 3.3400 -0.5210 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3320 1.9380 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3080 4.0420 -0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4360 6.5790 0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 7.7470 0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2280 5.3490 2.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1380 3.0640 1.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5000 2.4140 -1.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5910 4.6990 -1.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1990 -2.2640 -2.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 -3.8710 -1.8270 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 2 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 3 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 23 24 2 0 0 0 0 23 25 2 0 0 0 0 23 26 1 0 0 0 0 26 38 1 0 0 0 0 26 39 1 0 0 0 0 M END