PUBCHEM-ZINC02506178 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 37 0 0 0 0 0 0 0 0999 V2000 0.0260 1.5720 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 0.0520 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6390 -0.5000 -1.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6690 -2.0270 -1.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2850 -2.5700 -2.4980 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7710 -2.5710 -2.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4180 -3.9210 -2.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9640 -4.5110 -1.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3730 -2.9970 -3.8500 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 -3.9440 -4.6640 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9910 -3.2760 -3.4440 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3220 -1.4800 -4.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 -1.1640 -5.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3280 0.0060 -6.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2140 0.8580 -6.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8550 0.5060 -5.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8080 -0.6630 -4.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2680 1.4960 -5.3620 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.1930 2.1100 -7.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0280 1.9950 -0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6100 1.9380 -0.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3800 1.9450 0.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6910 -0.2820 0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9380 -0.3380 0.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1450 -2.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6460 -0.1000 -1.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2320 -2.3870 -0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3440 -2.4240 -1.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1030 -2.2480 -3.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1720 -1.8290 -1.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 -1.8180 -5.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1650 0.2440 -7.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6450 -0.9280 -4.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6360 2.0800 -7.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 2.9920 -6.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1180 2.2250 -7.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3790 -4.2560 -2.9540 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 37 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 33 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 M CHG 1 37 -1 M END