PUBCHEM-ZINC03204391 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 1 0 0 0 0 0999 V2000 -3.2420 1.8990 0.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3500 0.3830 0.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0040 -0.3040 0.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0220 0.3480 0.8180 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9620 -1.6810 0.2480 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6300 -2.3880 0.2400 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7120 -3.1640 -0.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4540 -3.1100 1.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7100 -3.8700 1.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9410 -4.9160 2.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1320 -5.6070 3.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6980 -6.6140 4.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0490 -6.9370 4.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8730 -6.2640 3.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2930 -5.2590 2.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8600 -4.4470 1.7920 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8320 -4.4800 1.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9130 -3.6050 1.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1550 -2.5680 0.2030 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0410 -2.0090 0.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4420 -3.1490 -1.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8490 -4.3430 -1.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1100 -4.8470 -2.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9780 -4.1730 -3.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5850 -2.9940 -3.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3250 -2.4820 -2.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5160 -2.2910 -4.2120 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.5510 -2.6330 -5.4040 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2290 -1.4060 -3.7170 O 0 5 0 0 0 0 0 0 0 0 0 0 0.6210 -1.6140 -0.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6200 -1.6430 0.5320 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2250 2.3560 0.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8560 2.2340 1.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5680 2.2730 -0.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0200 0.0530 1.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7730 0.1020 -0.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4010 -3.7950 1.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2680 -2.3830 2.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0790 -5.3610 3.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0730 -7.1470 5.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4690 -7.7220 5.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9240 -6.5150 3.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1620 -4.8980 -0.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6280 -5.7650 -3.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1670 -4.5790 -4.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8100 -1.5650 -1.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5310 -1.1270 -1.4120 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 19 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 30 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 18 2 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 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 13 14 2 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 46 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 30 31 2 0 0 0 0 30 47 1 0 0 0 0 M CHG 1 27 1 M CHG 1 29 -1 M CHG 1 47 -1 M END