PUBCHEM-ZINC02179603 MOE2007 3D CORINA 3.40 0006 02.08.2006 62 67 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7020 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -4.5300 -0.0230 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -4.9170 -1.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -4.9300 1.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 -5.0430 -0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3320 -4.7710 -1.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9710 -4.1180 -2.1550 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0370 -4.0400 -2.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2270 -3.4700 -4.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4440 -3.5560 -4.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5070 -4.2110 -4.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3320 -4.7830 -2.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1000 -4.7000 -2.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6200 -5.1440 -1.1760 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8240 -4.2970 -4.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8870 -4.9520 -4.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1040 -5.0380 -4.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2940 -4.4680 -6.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2310 -3.8090 -6.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0010 -3.7200 -6.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7090 -3.3700 -7.9860 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.9990 -3.7380 -8.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3600 -4.3900 -7.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.8200 -3.4670 -9.1510 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.3950 -3.9800 -9.1370 S 0 0 0 0 0 0 0 0 0 0 0 0 -12.9760 -3.5220 -10.3500 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.3680 -5.3490 -8.7570 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.2130 -3.1180 -7.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.8250 -1.9050 -8.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.4670 -1.2280 -7.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.4960 -1.7660 -5.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.8850 -2.9790 -5.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.2470 -3.6580 -6.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.1950 -1.0280 -4.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6060 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8540 -5.5350 0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4100 -2.9620 -4.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5870 -3.1150 -5.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1540 -5.2880 -2.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7440 -5.3940 -3.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9210 -5.5460 -4.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1810 -3.2100 -6.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4760 -2.9760 -9.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8020 -1.4850 -9.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.9450 -0.2800 -7.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.9080 -3.3990 -4.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7720 -4.6080 -6.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.2390 -1.3380 -4.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.7100 -1.2570 -3.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.1420 0.0450 -4.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 44 1 0 0 0 0 4 5 1 0 0 0 0 4 45 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 46 1 0 0 0 0 7 47 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 48 1 0 0 0 0 12 13 2 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 49 1 0 0 0 0 16 17 1 0 0 0 0 16 50 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 51 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 52 1 0 0 0 0 23 24 1 0 0 0 0 23 53 1 0 0 0 0 24 25 2 0 0 0 0 24 29 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 31 1 0 0 0 0 30 55 1 0 0 0 0 31 32 2 0 0 0 0 31 33 2 0 0 0 0 31 34 1 0 0 0 0 34 35 1 0 0 0 0 34 39 2 0 0 0 0 35 36 2 0 0 0 0 35 56 1 0 0 0 0 36 37 1 0 0 0 0 36 57 1 0 0 0 0 37 38 2 0 0 0 0 37 40 1 0 0 0 0 38 39 1 0 0 0 0 38 58 1 0 0 0 0 39 59 1 0 0 0 0 40 60 1 0 0 0 0 40 61 1 0 0 0 0 40 62 1 0 0 0 0 M END