IBS-ZINC02181784 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 0 0 0 0 0 0 0 0999 V2000 -0.0960 1.4070 -0.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 -0.0480 -0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4140 -0.6680 1.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5060 -2.0840 0.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2450 -2.5020 -0.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1050 -1.1790 -1.3850 S 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -3.8900 -0.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2690 -5.7640 -1.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7410 -6.1380 -1.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8850 -7.5320 -2.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9490 -8.6360 -1.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0350 -9.9310 -2.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0600 -10.1210 -3.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 -9.0380 -4.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9140 -7.7440 -3.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0870 -11.8080 -4.0640 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.4440 -11.6450 -5.3640 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2880 -12.5280 -3.0750 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6190 -12.2270 -4.1260 N 0 5 0 0 0 0 0 0 0 0 0 0 -5.0450 -11.6220 -4.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6190 1.7590 -1.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1100 1.6110 -0.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 1.9930 0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5830 -0.1320 1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 -2.7530 1.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7440 -3.9500 -1.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7110 -4.5870 -0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7610 -6.4300 -0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7360 -5.7720 -2.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2660 -6.0690 -0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2410 -5.4250 -2.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9260 -8.4990 -0.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0740 -10.7840 -1.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0110 -9.1960 -5.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8630 -6.9060 -4.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1680 -4.3740 -1.1020 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.6700 -4.3210 -0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6440 -3.7180 -1.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 36 37 1 0 0 0 0 36 38 1 0 0 0 0 M CHG 1 19 -1 M CHG 1 36 1 M END