IBS-ZINC02398077 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 61 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7020 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 0.0720 -2.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -4.5300 -0.0230 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -4.9170 -1.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -4.9300 1.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6110 -5.0760 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4130 -5.3280 -1.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7190 -5.7570 -0.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6820 -6.0640 -1.4730 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4650 -5.9820 -2.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4910 -6.3090 -3.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2630 -6.2240 -5.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0240 -5.8170 -5.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0090 -5.4940 -4.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2050 -5.5680 -3.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2130 -5.2510 -2.4530 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6180 -5.7360 0.7420 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3540 -5.3330 1.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9020 -5.2040 2.3940 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6870 -6.0910 1.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6130 -7.5870 1.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7120 -7.9530 2.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9460 -8.3510 2.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9550 -8.6870 3.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7300 -8.6250 4.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4950 -8.2270 5.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4850 -7.8960 4.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6060 -2.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 0.2690 -2.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5510 -0.5200 -3.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5590 1.0160 -2.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4560 -6.6260 -3.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0540 -6.4770 -5.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8690 -5.7580 -6.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0540 -5.1800 -5.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9940 -4.9100 2.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4940 -5.4070 3.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5690 -5.5200 2.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6540 -5.8620 1.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7310 -8.1580 1.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6460 -7.8160 2.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1220 -8.4000 1.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9200 -8.9970 2.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5180 -8.8860 5.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3200 -8.1780 6.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5200 -7.5880 4.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 8 42 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 24 2 0 0 0 0 13 14 1 0 0 0 0 13 22 2 0 0 0 0 14 15 2 0 0 0 0 14 23 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 20 2 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 53 1 0 0 0 0 30 31 1 0 0 0 0 30 54 1 0 0 0 0 31 32 2 0 0 0 0 31 55 1 0 0 0 0 32 33 1 0 0 0 0 32 56 1 0 0 0 0 33 57 1 0 0 0 0 M END