PUBCHEM-ZINC05633426 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 48 0 0 1 0 0 0 0 0999 V2000 -0.2010 1.6380 0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0970 0.1150 0.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 -0.2660 1.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4590 -0.5850 0.0160 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9030 -0.2250 -0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4700 -0.2950 1.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5870 -1.2410 2.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2820 -2.0410 -0.1490 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7580 -2.6400 -1.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4240 -2.0330 -2.2830 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6260 -4.1160 -1.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4390 -4.8130 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3030 -6.2030 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3530 -6.9030 -1.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 -6.2090 -2.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6610 -4.8150 -2.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5850 -6.9060 -3.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1950 -6.3220 -4.7680 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0900 -8.1840 -3.7460 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1510 -9.0770 -4.9180 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3780 -8.7600 -5.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5480 -9.0340 -5.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9480 -7.6150 -6.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6190 -9.9440 -6.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 -10.5400 -4.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 -10.8420 -3.3320 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7970 2.0900 0.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6970 1.9270 -0.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7550 2.0750 0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5810 -0.2110 -0.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 0.0870 2.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 -1.3500 1.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5690 0.1800 1.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6190 -2.5620 0.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3670 -4.2950 0.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1450 -6.7420 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2130 -7.9810 -1.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7900 -4.2740 -3.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4500 -8.6200 -2.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3010 -9.3870 -4.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2040 -7.1770 -6.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9120 -7.6200 -6.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0610 -6.9560 -5.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5000 -10.9980 -6.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5910 -9.8520 -7.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8420 -9.6850 -7.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0630 0.8180 1.1160 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.1470 -11.2300 -5.2300 O 0 5 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 2 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 6 7 2 0 0 0 0 6 47 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 38 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 39 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 25 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 M CHG 1 47 -1 M CHG 1 48 -1 M END