PUBCHEM-ZINC04600614 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 47 0 0 1 0 0 0 0 0999 V2000 -0.0330 1.4600 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1550 -0.7420 1.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2260 -1.0360 1.8470 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8020 -1.6350 1.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0680 -1.8060 3.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3570 -2.1820 3.6500 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3940 -2.8780 4.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6120 -3.2740 5.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6510 -3.9820 6.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4710 -4.2970 7.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2530 -3.9010 6.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2150 -3.1970 5.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5090 -4.9920 8.3610 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2560 -5.2820 8.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9100 0.1940 2.0960 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 -0.6730 -1.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1780 -1.8860 -1.1630 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1240 0.0690 -2.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6340 1.2310 -2.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6090 1.9180 -3.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1660 1.4590 -4.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9210 0.3080 -4.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8990 -0.3930 -3.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1890 2.2020 -6.1170 N 0 3 0 0 0 0 0 0 0 0 0 0 0.4740 3.2150 -6.2450 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8710 1.7990 -7.0430 O 0 5 0 0 0 0 0 0 0 0 0 0 0.9850 1.8500 -0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5750 1.8160 -0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5370 1.8050 0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 -1.6800 1.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -0.1430 1.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4700 -2.7000 2.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5700 -1.1730 3.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5310 -3.0300 4.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5990 -4.2900 6.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3340 -4.1460 7.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2660 -2.8930 5.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6420 -5.8770 8.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7410 -4.3490 9.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4280 -5.8400 9.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4540 0.7790 2.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2400 1.5910 -1.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 2.8180 -3.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5250 -0.0460 -5.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4850 -1.2940 -3.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 17 1 0 0 0 0 3 4 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 6 1 0 0 0 0 4 16 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 M CHG 1 25 1 M CHG 1 27 -1 M END