PUBCHEM-ZINC05159458 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 1 0 0 0 0 0999 V2000 -0.0220 1.8100 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 S 0 3 0 0 0 0 0 0 0 0 0 0 0.5370 -0.4140 1.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7600 -0.4360 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9120 -1.9590 0.0100 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3640 -2.3900 -0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4040 -2.3500 -0.0650 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0300 -1.5450 0.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5100 -3.6000 0.8370 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.1880 -3.4130 1.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0700 -3.8150 1.3510 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5450 -4.5330 0.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4440 -2.5160 1.2570 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0870 -4.2770 2.7410 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9690 -3.4960 3.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0270 -4.2340 4.9220 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1850 -5.5320 4.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2320 -5.5740 3.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3890 -6.7470 2.5580 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5040 -7.8540 3.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4690 -7.8640 4.5800 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3060 -6.7410 5.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2740 -6.7610 6.6560 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9490 -4.7290 0.0790 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7720 -2.6670 -1.4090 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 2.1870 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 2.1710 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 2.1610 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1780 -0.0090 2.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5880 -1.4970 1.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5210 0.0170 1.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2260 -0.0280 0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2430 -0.0190 -0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8460 -2.4230 3.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6310 -8.7910 2.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1660 -5.9330 7.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3580 -7.6020 7.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8250 -4.6210 -0.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6990 -2.9200 -1.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 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 18 1 0 0 0 0 15 16 2 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 24 38 1 0 0 0 0 25 39 1 0 0 0 0 M CHG 1 2 1 M END