IBS-ZINC05025038 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 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 -1.2010 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3730 0.1000 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6010 -0.5390 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6680 -1.9170 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4950 -2.6720 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2560 -2.0270 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 -2.7550 -0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5640 -4.1520 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4360 -4.8380 -0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4570 -6.1780 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2780 -6.9370 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3540 -8.2980 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5850 -8.9480 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7510 -8.2390 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7090 -6.8410 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8870 -6.0540 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7620 -4.7350 0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1320 -6.6450 0.0190 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3380 -5.8140 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5100 -6.5960 0.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5990 -6.6920 -0.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8230 -6.5270 -1.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7570 -5.4620 -1.4080 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 -2.3290 1.1800 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5100 0.0440 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6280 -2.4100 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2340 -2.9740 0.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6840 -6.4460 -0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5550 -8.8810 -0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6180 -10.0270 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7000 -8.7540 -0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2100 -7.6120 0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1560 -4.9020 0.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1810 -7.5940 0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8960 -6.0640 1.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0900 -7.6640 -0.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3290 -5.8900 -0.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3510 -7.4650 -2.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4820 -6.1640 -2.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1880 -4.4620 -1.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9030 -5.5360 -2.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 19 2 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 2 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 25 1 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 M END