IBS-ZINC01775727 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 -1.9860 -0.1420 0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5990 -0.7250 0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2760 -0.7560 1.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7630 -1.5180 0.6080 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0870 -1.7170 -0.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1210 -1.2520 -0.9850 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7960 -2.3510 -2.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -0.2650 2.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1260 1.0620 2.6810 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 -1.1460 3.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 -2.5440 3.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1520 -3.0720 4.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1710 -4.2490 5.1650 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2250 -2.0560 5.7450 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1660 -0.7890 5.0090 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0750 -0.2140 5.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0400 0.0050 5.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9510 1.3780 5.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0570 2.1080 5.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2520 1.4640 6.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3410 0.0890 6.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2330 -0.6400 5.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6410 2.3790 6.7280 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.3410 -2.1910 7.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0570 -2.2330 7.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9360 -2.3740 9.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2740 -2.4140 9.9340 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0040 -1.3400 10.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1680 -1.8240 10.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1500 -3.1580 10.7000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0160 -3.5190 10.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -3.2130 2.4680 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9530 0.9170 -0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6470 -0.6610 -0.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3590 -0.2620 1.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6010 -3.4230 -2.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4330 -1.9110 -3.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8690 -2.1780 -2.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 1.8810 5.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9870 3.1810 6.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2740 -0.4140 6.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3010 -1.7130 5.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8920 -1.3400 7.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8720 -3.1130 7.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6070 -3.0840 7.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5880 -1.3110 7.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3850 -1.5240 9.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4050 -3.2960 9.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7040 -0.3030 10.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9750 -1.2400 11.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7210 -4.5340 9.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2900 1.3000 3.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 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 8 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 10 2 0 0 0 0 9 52 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 32 2 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 24 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 31 1 0 0 0 0 28 29 2 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 30 31 2 0 0 0 0 31 51 1 0 0 0 0 M END