NCID-ZINC04768997 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 -0.2870 1.6000 -0.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0980 0.1140 -0.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4840 -0.4540 -1.4850 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7230 -1.7980 -1.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4720 -2.4990 -0.4360 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3680 -2.2800 -2.7060 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7610 -1.8750 -3.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8140 -1.7460 -2.8060 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8360 -0.6790 -2.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8340 -1.9750 -4.0520 C 0 0 3 0 0 0 0 0 0 0 0 0 5.2560 -0.9740 -3.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1950 -2.9280 -2.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9630 -2.5780 -1.6490 S 0 0 0 0 0 0 0 0 0 0 0 0 5.4100 -2.6400 -5.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6520 -3.4890 -5.8870 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2840 -3.7440 -2.7700 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 -4.4170 -3.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7230 -3.8280 -3.8680 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2940 -5.9490 -3.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9520 -6.6790 -3.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7820 -7.3580 -2.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9200 -8.0410 -3.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2440 -8.0550 -4.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4310 -7.3830 -5.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2940 -6.7010 -5.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5860 -6.5640 -3.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1140 -7.7090 -3.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 -8.2840 -3.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9850 -7.7250 -4.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4680 -6.5990 -5.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2710 -6.0300 -4.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6730 2.0800 -0.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9350 1.7740 -1.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7310 2.0800 0.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5680 -0.0440 0.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0680 -0.3560 -0.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1200 -3.9850 -3.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2010 -2.7400 -2.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0470 -4.2660 -2.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3320 -6.0800 -2.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5530 -7.3620 -1.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5540 -8.5600 -2.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1290 -8.5850 -4.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6830 -7.3860 -6.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6790 -6.1780 -5.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6020 -8.1600 -2.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7040 -9.1640 -3.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9200 -8.1590 -4.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0040 -6.1450 -6.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9020 -5.1510 -5.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3550 -1.8970 -4.1610 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0670 -2.7920 -4.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5810 -2.2750 -5.6320 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 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 6 16 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 51 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 14 1 0 0 0 0 10 51 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 14 15 2 0 0 0 0 14 53 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 26 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 46 1 0 0 0 0 28 29 1 0 0 0 0 28 47 1 0 0 0 0 29 30 2 0 0 0 0 29 48 1 0 0 0 0 30 31 1 0 0 0 0 30 49 1 0 0 0 0 31 50 1 0 0 0 0 51 52 1 0 0 0 0 M CHG 1 53 -1 M END