PUBCHEM-ZINC00005681 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4650 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 3 0 0 0 0 0 0 0 0 0 0 0.7120 -0.4900 1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 0.0180 2.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3820 -0.4620 2.4580 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0990 -0.0040 1.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 -0.5120 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0370 -0.0670 3.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5070 0.6300 4.5530 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2780 0.9390 5.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9370 1.6820 6.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8610 1.8970 7.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1500 1.3860 7.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5050 0.6560 6.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5760 0.4310 5.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7130 -0.4380 3.9860 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.0590 1.6050 8.6310 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 -0.4780 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 0.0220 -2.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 0.7060 -3.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8420 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8260 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8160 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7160 -1.5800 1.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7390 -0.1230 1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5250 -0.3550 3.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 1.1080 2.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1180 -0.3930 1.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1260 1.0860 1.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8980 -0.1610 -0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3610 -1.6020 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9400 2.0850 6.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5860 2.4680 8.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5050 0.2590 6.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5810 2.4110 8.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7130 -0.1000 -1.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7050 -1.5670 -1.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0910 -0.1840 -2.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6590 0.9130 -3.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 1.0640 -4.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 18 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 6 29 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 2 0 0 0 0 8 16 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 M CHG 1 2 1 M END