PUBCHEM-ZINC04193670 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 59 0 0 0 0 0 0 0 0999 V2000 -0.7060 -1.2930 1.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3960 -0.6010 0.4780 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7530 -0.9520 -0.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8170 -0.2210 -1.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2860 -0.4720 -2.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6860 -1.4520 -3.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6370 -2.2030 -2.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1660 -1.9510 -1.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1010 -1.7940 -4.7180 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9140 -1.1320 -5.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0490 0.5480 -5.7350 S 0 0 0 0 0 0 0 0 0 0 0 0 3.5660 -2.0230 -6.5280 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1510 -1.5750 -7.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6430 -1.2630 -7.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1980 -0.7390 -8.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0870 0.5350 -10.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5330 0.9840 -9.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3940 -0.1440 -9.6350 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0320 -0.8980 -8.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6120 -1.4490 -8.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -3.4640 -6.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5270 -4.2700 -6.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6350 -5.1140 -7.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5090 -5.8240 -8.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3140 -5.6740 -7.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2930 -4.8100 -6.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3660 -4.1030 -6.0220 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6200 -1.1330 0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4880 -2.3610 1.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8730 -0.8850 2.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2930 0.5480 -0.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1430 0.0970 -2.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 -2.9900 -3.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6550 -2.5550 -1.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7040 -2.6730 -5.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9950 -2.3630 -8.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6110 -0.6980 -8.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8080 -0.5270 -6.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1720 -2.1720 -7.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1660 -1.4950 -9.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6320 0.1430 -9.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4150 1.3960 -10.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9900 -0.1050 -10.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8790 1.5290 -10.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6250 1.6550 -8.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7410 -1.7260 -8.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1360 -0.2690 -7.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5180 -2.1120 -9.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3230 -1.9720 -7.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6430 -3.8320 -6.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8140 -3.6010 -5.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5710 -5.2250 -8.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5630 -6.4910 -9.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5770 -6.2160 -7.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6180 -4.6590 -5.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6370 -0.2980 -8.8240 N 0 3 0 0 0 0 0 0 0 0 0 0 7.6800 0.3150 -7.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 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 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 15 56 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 16 56 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 20 56 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 52 1 0 0 0 0 24 25 1 0 0 0 0 24 53 1 0 0 0 0 25 26 2 0 0 0 0 25 54 1 0 0 0 0 26 27 1 0 0 0 0 26 55 1 0 0 0 0 56 57 1 0 0 0 0 M CHG 1 56 1 M END