PUBCHEM-ZINC06220838 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 -0.0150 1.4130 -0.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 0.0190 -1.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 -0.6550 -0.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 0.0470 -0.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3290 1.4430 -0.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1360 2.1280 -0.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7590 2.3530 0.2040 S 0 0 0 0 0 0 0 0 0 0 0 0 3.2860 3.5810 0.8070 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5990 1.4370 0.9460 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5550 2.7450 -1.2520 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9330 3.7520 -2.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0220 4.3990 -3.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3450 2.2570 -2.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2300 1.6570 -2.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8660 3.9870 -4.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4110 3.0870 -5.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6620 2.8340 -6.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1700 2.0060 -7.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4270 1.4240 -7.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1800 1.6620 -6.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6740 2.4910 -5.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0540 0.4090 -9.0020 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.2480 -2.1170 -0.7830 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1690 -2.7210 -0.7100 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3560 -2.6550 -0.9110 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9460 1.9420 -1.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8900 -0.5200 -1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3010 -0.4800 -0.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0830 3.2120 -0.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1780 3.2710 -2.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4440 4.5390 -1.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5770 5.0870 -3.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7560 4.9320 -2.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1200 2.7270 -2.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7870 1.4810 -3.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6820 0.9320 -1.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4980 1.1320 -2.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6550 4.3400 -3.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4160 4.8690 -5.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6850 3.2900 -7.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5860 1.8260 -8.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1640 1.2120 -6.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2820 2.6690 -4.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7900 3.3430 -3.8090 N 0 3 0 0 0 0 0 0 0 0 0 0 5.1270 2.8910 -4.4510 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 13 44 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 44 45 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M CHG 1 44 1 M END