IBS-ZINC04038570 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 0 0 0 0 0 0999 V2000 0.0540 1.4510 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -0.0790 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3610 -0.5440 0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1960 -0.7030 -1.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3450 -1.1390 -0.6110 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2870 -1.2610 0.6670 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0950 -0.9160 1.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5480 -0.9270 2.7740 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.0490 -1.5230 3.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8090 -1.6150 5.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0370 -0.6120 5.9660 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3750 0.2740 5.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6960 -1.0870 7.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7090 -0.5430 8.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2940 -1.3050 9.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8630 -2.6100 9.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8430 -3.1620 8.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2610 -2.4080 7.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3600 -2.6680 5.6950 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8620 -0.4350 -2.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6790 -0.9310 -3.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3730 -0.6770 -4.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2350 0.0690 -5.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4100 0.5660 -4.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7350 0.3140 -3.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8920 0.7980 -2.7640 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7320 1.5530 -3.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0870 1.7970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4670 1.8330 -0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4410 1.8130 0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5230 -0.4400 -0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5490 -0.4610 0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8680 -0.8300 3.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3070 -2.5090 3.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0430 0.4730 8.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3030 -0.8830 10.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5400 -3.1960 10.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5060 -4.1790 7.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -1.5130 -2.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5430 -1.0620 -4.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9880 0.2640 -6.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0780 1.1480 -5.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1880 2.4250 -4.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0290 0.9320 -4.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6210 1.8790 -3.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 19 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 M END