IBS-ZINC06623673 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3820 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1990 -0.6920 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3950 0.0100 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 1.4150 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 2.0970 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6670 2.1290 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7070 3.3440 -0.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8030 1.3980 -0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7680 0.0560 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8200 -0.5530 -0.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6200 -0.6420 -0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6480 -1.6120 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0980 2.0830 -0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5550 2.3110 1.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8660 1.9380 2.3010 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7280 2.9290 1.6130 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1720 3.1510 2.9920 C 0 0 3 0 0 0 0 0 0 0 0 0 7.8590 2.3120 3.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6980 3.2670 3.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3110 1.9530 2.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5880 1.7070 1.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1500 0.5030 0.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4360 -0.4590 1.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1570 -0.2100 3.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6000 0.9980 3.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9890 -1.6440 1.4900 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5600 4.4230 3.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8280 5.0770 2.8150 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9060 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -0.5520 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 -1.7720 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 3.1760 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8300 1.4690 -0.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9980 3.0420 -0.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2790 3.2280 0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0170 4.0480 2.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0220 3.5200 4.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3650 2.4560 0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3660 0.3110 -0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3780 -0.9570 3.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3870 1.1950 4.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9560 -1.6440 1.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8280 4.8290 4.7700 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4120 5.6510 5.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 12 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 28 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 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 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 41 1 0 0 0 0 26 42 1 0 0 0 0 27 43 1 0 0 0 0 28 29 2 0 0 0 0 28 44 1 0 0 0 0 44 45 1 0 0 0 0 M END