PUBCHEM-ZINC01137630 MOE2007 3D CORINA 3.40 0006 02.08.2006 66 68 0 0 0 0 0 0 0 0999 V2000 -0.2720 1.4140 1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2930 0.1900 0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6850 -0.8610 0.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6840 -0.3900 0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3700 -0.4730 -1.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6440 -1.0040 -1.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2380 -1.4540 0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5460 -1.3690 1.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2690 -0.8430 1.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5270 -1.9910 0.0860 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7980 -3.2040 -0.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4680 -4.4160 0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0470 -4.2800 1.2720 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6390 -5.6520 -0.3680 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4300 -6.7720 0.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3410 -6.8210 1.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1350 -7.9320 2.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0120 -9.0050 2.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0980 -8.9730 1.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3220 -7.8530 0.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4870 -7.8100 -0.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6380 -6.8660 -1.2760 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3840 -8.8160 -0.5170 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.5400 -8.7730 -1.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6730 -9.6180 -0.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8820 -9.5730 -1.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4860 -10.1310 -3.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3530 -9.2870 -3.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1450 -9.3320 -2.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7490 -1.2560 0.9280 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.6060 -2.3250 1.3060 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0790 -0.4730 1.9060 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5620 -0.1900 -0.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7340 1.8330 1.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9690 2.1620 0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5650 1.1180 2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.4860 -0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3920 -1.1570 1.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6700 -1.7330 0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6910 -0.4420 0.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9080 -0.1220 -1.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1800 -1.0680 -1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0040 -1.7190 2.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7290 -0.7810 2.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8510 -3.2300 -0.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1840 -3.2040 -1.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9080 -5.7610 -1.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6540 -5.9900 1.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2860 -7.9670 2.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8420 -9.8690 2.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7780 -9.8110 1.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2630 -9.5690 0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8760 -7.7420 -1.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3380 -10.6490 -0.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9550 -9.2200 0.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6880 -10.1740 -1.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2170 -8.5420 -1.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1500 -11.1620 -3.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3460 -10.0990 -3.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0710 -9.6850 -4.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6880 -8.2560 -3.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3380 -8.7300 -3.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8090 -10.3630 -2.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8100 -0.7750 -1.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4750 0.2240 0.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8910 0.6230 -0.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 37 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 3 40 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 41 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 43 1 0 0 0 0 9 44 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 45 1 0 0 0 0 11 46 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 47 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 48 1 0 0 0 0 17 18 1 0 0 0 0 17 49 1 0 0 0 0 18 19 2 0 0 0 0 18 50 1 0 0 0 0 19 20 1 0 0 0 0 19 51 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 52 1 0 0 0 0 24 25 1 0 0 0 0 24 29 1 0 0 0 0 24 53 1 0 0 0 0 25 26 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 26 56 1 0 0 0 0 26 57 1 0 0 0 0 27 28 1 0 0 0 0 27 58 1 0 0 0 0 27 59 1 0 0 0 0 28 29 1 0 0 0 0 28 60 1 0 0 0 0 28 61 1 0 0 0 0 29 62 1 0 0 0 0 29 63 1 0 0 0 0 30 31 2 0 0 0 0 30 32 2 0 0 0 0 30 33 1 0 0 0 0 33 64 1 0 0 0 0 33 65 1 0 0 0 0 33 66 1 0 0 0 0 M END