IBS-ZINC05070917 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 0 0 0 0 0 0999 V2000 -9.0830 3.1640 -3.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6220 2.9820 -4.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7040 2.4880 -3.2700 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0040 3.0660 -5.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5310 2.4660 -3.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6910 2.9580 -5.1140 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.0530 3.2780 -5.2390 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0190 1.8970 -3.1610 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.5560 1.5580 -1.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0780 2.2920 -0.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6860 2.1670 0.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0780 2.1630 0.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6400 2.0450 2.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8340 1.9310 3.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4570 1.9330 3.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8730 2.0450 1.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5210 2.0430 1.8630 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7600 1.9150 3.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2900 1.9320 2.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3980 3.1310 2.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7460 3.1460 2.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4070 1.9620 2.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7200 0.7630 2.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3720 0.7480 2.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5210 0.4810 -1.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7950 0.1620 -0.1280 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.2410 4.1550 -3.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6700 3.0630 -4.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3950 2.4060 -3.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2510 2.9690 -0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7100 2.2530 0.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7140 2.0430 2.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2830 1.8390 4.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8360 1.8440 4.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9910 2.7460 3.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0100 0.9750 3.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1190 4.0550 2.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2830 4.0830 2.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4600 1.9740 1.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2360 -0.1610 1.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1640 -0.1890 2.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1030 -0.1560 -2.3060 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7320 -0.8590 -2.0920 H 0 0 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 7 2 0 0 0 0 3 5 2 0 0 0 0 4 6 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 25 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 16 2 0 0 0 0 12 13 2 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 14 15 2 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 18 36 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 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 23 2 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 41 1 0 0 0 0 25 26 2 0 0 0 0 25 42 1 0 0 0 0 42 43 1 0 0 0 0 M END