IBS-ZINC02132931 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 0 0 0 0 0 0999 V2000 -0.0660 1.3990 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -0.0430 0.0060 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -0.8300 1.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 -0.5240 2.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 0.6020 2.9980 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1260 -1.6640 3.2990 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1630 -1.5210 4.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1150 -2.9890 2.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1470 -3.8870 3.7190 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 -3.2060 1.4990 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -2.1130 0.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -2.1530 -0.7050 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 -0.8900 -1.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0190 -0.4230 -2.3550 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 -1.3680 -3.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0470 -0.6230 -4.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0650 -1.5990 -5.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 -0.8630 -7.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1000 -1.8480 -8.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1140 -1.1170 -9.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -4.5530 0.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9590 1.7750 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5890 1.7460 -0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6170 1.7550 0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 0.5630 -2.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8530 -2.0130 -3.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9220 -2.0080 -3.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 0.0330 -4.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8350 0.0260 -4.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8160 -2.2510 -5.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9490 -2.2450 -5.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 -0.2110 -7.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8040 -0.2190 -7.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7800 -2.5020 -8.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9840 -2.4930 -8.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0070 -0.4970 -9.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7820 -0.5070 -9.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0920 -5.3050 1.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8530 -4.6980 0.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9350 -4.6860 0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1340 -2.1170 -10.9070 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.1430 -1.6600 -11.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9660 -2.7180 -10.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6930 -2.7270 -10.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 13 1 0 0 0 0 3 4 1 0 0 0 0 3 11 2 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 21 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 25 1 0 0 0 0 15 16 1 0 0 0 0 15 26 1 0 0 0 0 15 27 1 0 0 0 0 16 17 1 0 0 0 0 16 28 1 0 0 0 0 16 29 1 0 0 0 0 17 18 1 0 0 0 0 17 30 1 0 0 0 0 17 31 1 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 20 41 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 41 42 1 0 0 0 0 41 43 1 0 0 0 0 41 44 1 0 0 0 0 M CHG 1 41 1 M END