PUBCHEM-ZINC05782915 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 57 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -0.5030 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1660 -0.6860 2.4470 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7600 -0.5210 2.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 -1.1510 3.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 -1.5120 4.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3760 -1.9500 5.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5280 -2.0300 4.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5100 -1.6780 3.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3220 -1.2330 2.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9900 -0.8270 1.2580 N 0 3 0 0 0 0 0 0 0 0 0 0 2.9110 -0.7620 0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5710 0.6180 0.0780 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8000 1.3880 0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4370 0.7300 -1.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9730 2.0890 -1.2830 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1740 2.5100 -0.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1500 1.8490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2720 2.5270 0.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4410 3.8700 0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4850 4.5420 -0.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3460 3.8680 -1.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1620 4.2750 -1.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3540 3.1350 -1.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1540 3.2220 -2.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7730 4.4170 -3.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5760 5.5420 -3.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7630 5.4780 -2.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3890 0.7910 1.2360 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -0.4990 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3000 -1.4510 5.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4070 -2.2310 6.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4480 -2.3740 4.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4120 -1.7450 2.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6790 -1.5280 0.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3590 -0.9300 -0.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2600 0.0180 -1.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8310 0.5100 -2.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0280 0.8030 0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0260 2.0090 0.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3240 4.3910 0.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6180 5.5870 -0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5220 2.3520 -2.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8420 4.4780 -3.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2670 6.4720 -3.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3880 6.3540 -2.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0980 0.1390 1.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8530 -0.2240 0.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 32 1 0 0 0 0 4 5 1 0 0 0 0 4 13 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 31 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 26 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 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 23 2 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 29 2 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 31 52 1 0 0 0 0 32 53 1 0 0 0 0 M CHG 1 13 1 M END