IBS-ZINC06662409 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 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 -1.2000 -0.6370 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3730 0.1050 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5950 -0.5310 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6550 -1.9290 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4720 -2.6770 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2510 -2.0300 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1000 -2.7530 -0.0240 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2270 -4.1770 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9570 -2.6110 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0970 -1.8880 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3930 -2.5660 0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4440 -3.7830 0.0560 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.5310 -1.8450 0.0780 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.8290 -2.5240 0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9500 -1.4830 0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2850 -2.1820 0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9410 -2.6430 1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.0880 -3.1980 0.7940 N 0 0 0 0 0 0 0 0 0 0 0 0 -14.1780 -3.1020 -0.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.0640 -2.4630 -0.9750 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.8620 -2.2510 -1.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.2980 -3.5970 -1.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.3870 -4.2310 -0.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.4290 -4.6910 -1.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.3950 -4.5240 -2.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.3180 -3.8960 -3.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.2730 -3.4270 -2.7280 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 -2.3280 1.1840 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5060 0.0490 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5130 -3.7560 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7600 -4.5010 0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7820 -4.4840 -0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7640 -4.6300 -0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0020 -3.6900 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0530 -0.8090 0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4910 -0.8760 0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9220 -3.1430 -0.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9040 -3.1530 0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8570 -0.8640 0.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8750 -0.8540 -0.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5980 -2.5760 2.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.4150 -4.3620 0.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.2720 -5.1820 -1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.2130 -4.8850 -3.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.2970 -3.7700 -4.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.4350 -2.9330 -3.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 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 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 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 35 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 2 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 44 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 2 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 28 2 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 29 51 1 0 0 0 0 M END