PUBCHEM-ZINC04773678 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 39 0 0 1 0 0 0 0 0999 V2000 0.2890 -0.5100 2.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5050 -0.7500 1.8350 S 0 3 0 0 0 0 0 0 0 0 0 0 -1.9470 1.0150 1.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5380 -0.9130 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2530 -2.2120 -0.3560 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2430 -2.3160 -1.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6860 -2.3500 0.1690 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.2570 -3.0060 -0.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5170 -3.0330 1.5400 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.3970 -3.6650 1.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3290 -3.9760 1.1940 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.7150 -4.8710 0.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5010 -3.3050 0.2020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5090 -4.4440 2.2950 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6910 -5.5860 3.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6430 -5.5740 3.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5540 -6.6510 4.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4990 -7.6230 4.7430 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4720 -7.5030 3.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6470 -6.5220 2.9040 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4400 -6.7790 5.7700 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 -4.4530 3.7280 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4140 -3.7650 2.7230 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2090 -2.0810 2.4230 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.3740 -1.1120 0.2830 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4740 -1.0310 1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5150 -0.2780 3.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8180 -1.4260 1.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6540 0.3050 1.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3490 1.6140 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0050 1.1420 1.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7830 1.3790 2.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0460 -0.0570 -0.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5130 -0.9400 -0.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2040 -8.3040 3.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1610 -6.0780 5.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4230 -7.5960 6.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 13 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 25 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 24 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 23 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 22 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 22 23 2 0 0 0 0 25 26 1 0 0 0 0 M CHG 1 2 1 M CHG 1 24 -1 M END