PUBCHEM-ZINC02145321 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 3.5970 0.1310 3.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1700 -1.1480 3.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0700 -1.5540 2.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3990 -0.6750 1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8290 0.6160 1.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9270 1.0130 2.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1630 1.5070 0.4750 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2730 -1.1890 -0.4860 S 0 0 0 0 0 0 0 0 0 0 0 0 2.7850 -2.9300 -0.3450 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9300 -3.0150 0.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4060 -3.4670 -1.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1990 -2.7850 -2.2020 N 0 3 0 0 0 0 0 0 0 0 0 0 1.1060 -1.5740 -2.1040 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2890 -3.4280 -2.6930 O 0 5 0 0 0 0 0 0 0 0 0 0 3.9360 -3.7320 0.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7500 -4.5350 1.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8060 -5.2700 1.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0470 -5.2020 1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2330 -4.4000 0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1760 -3.6680 -0.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1990 -6.0030 1.7700 C 0 0 3 0 0 0 0 0 0 0 0 0 6.8980 -6.4740 2.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5990 -7.0820 0.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6300 -7.9410 1.3500 N 0 3 0 0 0 0 0 0 0 0 0 0 8.5250 -9.1530 1.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5910 -7.4450 1.9090 O 0 5 0 0 0 0 0 0 0 0 0 0 8.6100 -4.9040 2.0720 S 0 0 0 0 0 0 0 0 0 0 0 0 8.0800 -3.9510 3.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8640 -4.2240 4.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4510 -3.4750 5.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2470 -2.4530 5.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4600 -2.1730 5.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8850 -2.9220 3.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1160 -2.6440 3.3410 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6690 0.4440 4.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9130 -1.8330 4.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7370 -2.5540 1.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2600 2.0120 3.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0950 1.2280 -0.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4620 2.4040 0.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2240 -3.2860 -2.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2150 -4.5380 -1.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7800 -4.5880 1.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6600 -5.8980 2.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2030 -4.3460 -0.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3210 -3.0430 -1.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7270 -7.6830 0.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9910 -6.6100 -0.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2400 -5.0220 3.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5040 -3.6890 5.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9190 -1.8710 6.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0790 -1.3730 5.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4110 -3.1670 2.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6750 -1.9290 3.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 35 1 0 0 0 0 2 3 2 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 38 1 0 0 0 0 7 39 1 0 0 0 0 7 40 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 15 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 27 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 49 1 0 0 0 0 30 31 1 0 0 0 0 30 50 1 0 0 0 0 31 32 2 0 0 0 0 31 51 1 0 0 0 0 32 33 1 0 0 0 0 32 52 1 0 0 0 0 33 34 1 0 0 0 0 34 53 1 0 0 0 0 34 54 1 0 0 0 0 M CHG 1 12 1 M CHG 1 14 -1 M CHG 1 24 1 M CHG 1 26 -1 M END