PUBCHEM-ZINC00682113 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 59 0 0 0 0 0 0 0 0999 V2000 -0.0880 1.3480 -0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4300 1.3180 1.2630 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3180 0.1600 2.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8390 -0.0880 2.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9480 -1.2390 3.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 -2.1540 3.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2470 -1.9250 2.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3710 -0.7680 2.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6020 -0.5200 1.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7450 0.5310 0.6860 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5690 -1.4570 1.2350 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6790 -1.2720 0.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5900 -0.4600 -0.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6920 -0.2780 -1.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8940 -0.9010 -1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0000 -1.7100 -0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8950 -1.8990 0.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0040 -2.7590 1.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0180 -2.9980 2.5880 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1980 -3.2800 2.2670 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3060 -4.1340 3.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7570 -4.5900 3.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8680 -5.4680 4.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6950 -6.8350 4.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7980 -7.6400 5.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0740 -7.0790 7.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2480 -5.7130 7.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1500 -4.9080 6.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 2.6630 1.9060 S 0 0 0 0 0 0 0 0 0 0 0 0 2.1160 2.1450 2.8100 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5420 3.4260 0.7730 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1810 3.5020 2.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1280 1.6750 -0.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5040 2.0420 -0.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 0.3510 -0.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6540 0.6200 2.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8490 -1.4270 4.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -3.0510 4.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0550 -2.6420 2.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4910 -2.2620 1.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6570 0.0280 -0.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6180 0.3540 -2.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7500 -0.7520 -1.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9390 -2.1940 0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9840 -3.0900 1.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9960 -3.5730 4.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6630 -5.0060 3.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0660 -5.1510 2.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4000 -3.7180 3.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4800 -7.2730 3.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6620 -8.7080 5.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1530 -7.7090 7.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4630 -5.2740 8.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2890 -3.8400 6.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5090 2.8750 3.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 4.4530 3.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 3.6810 2.1350 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 29 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 6 7 2 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 8 9 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 40 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 15 16 2 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 26 27 2 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 28 54 1 0 0 0 0 29 30 2 0 0 0 0 29 31 2 0 0 0 0 29 32 1 0 0 0 0 32 55 1 0 0 0 0 32 56 1 0 0 0 0 32 57 1 0 0 0 0 M END