PUBCHEM-ZINC03737851 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 -0.7790 -1.7810 -0.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4700 -2.5670 0.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5690 -1.8770 1.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9130 -2.2670 1.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9530 -1.6900 2.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 -0.7010 3.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3290 -0.2930 3.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2670 -0.8580 2.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1550 -0.3820 2.8440 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8460 -0.7660 2.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3220 1.1050 2.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0670 1.8370 3.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9670 3.2150 3.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4690 4.4300 3.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1720 5.6270 3.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3990 5.6450 2.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8740 4.4510 1.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1800 3.2610 2.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8020 1.9710 1.9330 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2240 1.7220 1.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0800 6.9510 1.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3220 4.5030 5.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7930 1.1750 4.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9660 -0.3320 4.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1960 -2.1810 1.9270 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2980 -1.5980 2.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 -1.6580 -1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5310 -2.3070 -1.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1660 -0.7820 -0.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3840 -2.7460 1.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1140 -3.5670 0.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1620 -3.0410 0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4260 -0.2240 3.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1400 0.4920 4.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5560 6.5690 3.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2550 4.4480 0.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1800 7.3890 1.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9140 6.8090 0.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9100 7.6580 1.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9150 3.8600 5.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3590 5.5200 5.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3430 4.1860 4.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2210 1.3200 5.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7810 1.6250 5.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2610 -0.8620 5.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7050 -0.5280 3.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2100 -2.0860 2.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3820 -0.5290 2.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2270 -1.7720 3.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6680 -0.9430 4.1550 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.7620 -1.9610 4.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9480 -0.7890 4.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 7 2 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 50 1 0 0 0 0 11 12 2 0 0 0 0 11 19 1 0 0 0 0 12 13 1 0 0 0 0 12 23 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 22 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 50 51 1 0 0 0 0 50 52 1 0 0 0 0 M CHG 1 50 1 M END