CHEMDIV-ZINC06893582 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 58 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2010 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 0.0990 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5960 -0.5460 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6520 -1.9280 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4850 -2.6690 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2570 -2.0280 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 -2.7560 -0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2420 -4.1790 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9870 -2.6270 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4530 -2.8560 -1.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7510 -3.5350 -1.3940 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3600 -3.8420 -2.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8310 -3.5540 -3.6140 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6590 -4.5220 -2.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3920 -4.8940 -3.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5570 -5.5100 -3.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5170 -5.5030 -1.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3660 -4.9100 -1.4320 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.0880 -4.7800 -0.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8490 -6.1750 -4.1830 S 0 0 0 0 0 0 0 0 0 0 0 0 -13.0170 -6.1820 -3.3740 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.7750 -5.5080 -5.4350 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.4750 -7.7620 -4.4760 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.9340 -8.8200 -3.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6810 -9.8810 -4.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7810 -10.3750 -5.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4390 -9.2060 -6.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6820 -8.1380 -5.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3340 1.1790 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5100 0.0290 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5310 -3.7480 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7770 -4.5010 0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7980 -4.4840 -0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7470 -4.6370 -0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8910 -3.5870 0.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7160 -2.0100 0.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5490 -1.8960 -1.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7240 -3.4730 -1.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1720 -3.7650 -0.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1180 -4.7380 -4.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2760 -5.9080 -1.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0750 -9.2750 -3.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6030 -8.3940 -2.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9430 -10.7180 -3.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5880 -9.4460 -4.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8630 -10.7870 -5.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3010 -11.1470 -6.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8170 -9.5640 -7.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3580 -8.7780 -6.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5270 -7.2630 -6.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7200 -8.5370 -5.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 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 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 44 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 M END