PUBCHEM-ZINC03601545 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 -0.3580 1.5200 1.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2140 0.0680 0.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5190 -0.5090 0.7180 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6050 -1.8280 0.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 -2.6610 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7990 -3.9980 -0.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1030 -4.5260 -0.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1920 -3.6880 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9040 -2.3440 0.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6740 -4.0720 0.0030 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.0970 -3.6180 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1180 -5.5540 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3980 -6.3840 1.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0380 -6.7620 2.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3660 -7.5390 3.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0550 -7.9480 2.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4070 -7.5770 1.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0720 -6.7920 0.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2170 -6.2760 -0.6290 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.0310 -3.8090 -2.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6320 -2.8430 -3.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4520 -2.2690 -2.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8980 -3.2190 -1.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6370 -1.7930 -4.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6190 2.0110 1.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9940 2.0640 0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8370 1.5930 2.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2510 0.0260 -0.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4110 -0.4550 1.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4780 -2.3130 0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -4.6360 -0.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7080 -1.6650 0.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1940 -5.6030 0.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0070 -6.0420 -0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0650 -6.4650 2.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8690 -7.8300 4.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5350 -8.5550 3.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3820 -7.8970 1.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4320 -4.8190 -2.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9410 -3.8240 -2.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1420 -1.8640 -3.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4010 -3.2320 -4.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5430 -2.2430 -1.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0810 -1.2530 -1.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0990 -2.8260 -0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3250 -4.2220 -1.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4140 -2.1540 -5.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2330 -0.7790 -4.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7280 -1.7400 -4.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3900 -3.3330 -1.1560 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.0440 -2.3670 -1.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0900 -2.7070 -3.4420 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 19 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 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 10 50 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 20 50 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 21 52 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 22 52 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 23 50 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 24 52 1 0 0 0 0 50 51 1 0 0 0 0 M CHG 1 50 1 M END