PUBCHEM-ZINC03743652 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -0.5840 2.0780 1.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6850 0.6070 0.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1610 -0.1180 1.5730 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2800 -1.4710 1.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4470 -2.2060 0.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2590 -3.5850 0.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6580 -4.2320 1.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3890 -3.5140 2.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 -2.1260 2.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0100 -1.3260 3.2600 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5330 -0.3490 3.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4270 -1.0600 2.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4490 -2.0160 2.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7290 -1.7370 2.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0200 -0.4990 1.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3020 -0.2070 1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5720 1.0290 0.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5670 1.9850 0.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2880 1.7090 1.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 0.4710 1.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7170 0.1770 2.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7470 -1.1140 5.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0150 -1.3830 7.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5580 -1.3480 6.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -2.0850 5.2490 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1890 -1.6460 4.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2410 -3.5670 5.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0740 -4.4410 5.2260 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8940 -5.9290 0.9890 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.4510 2.4260 0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2150 2.6840 0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8920 2.2430 2.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7240 0.2790 0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3530 0.4680 -0.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1690 -1.7370 -0.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8300 -4.1410 -0.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1040 -4.0540 2.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2750 -2.9940 3.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5010 -2.4990 2.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1020 -0.9410 1.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5680 1.2430 0.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7780 2.9470 0.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5160 2.4700 0.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9310 0.9260 2.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7000 -0.0540 5.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7800 -1.4710 5.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2790 -2.3720 7.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 -0.6390 7.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0900 -1.7940 7.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2390 -0.3090 6.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9620 -1.9030 4.6780 N 0 3 0 0 0 0 0 0 0 0 0 0 2.3600 -2.8560 4.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -3.8360 5.7980 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0970 -4.8130 5.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 51 1 0 0 0 0 12 13 1 0 0 0 0 12 21 2 0 0 0 0 13 14 2 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 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 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 22 51 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 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 51 1 0 0 0 0 27 28 2 0 0 0 0 27 53 1 0 0 0 0 51 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 51 1 M END