IBS-ZINC02355853 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 62 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0640 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8480 -2.5930 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8270 -4.1230 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1680 -4.6180 0.0170 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3260 -5.9580 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3510 -6.6860 -0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6280 -6.5170 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4260 -6.8700 1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6850 -7.4060 0.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6140 -7.8130 1.5190 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.4030 -7.7340 2.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3920 -8.1670 3.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1700 -8.0830 5.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9720 -7.5720 5.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9920 -7.1440 4.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1850 -7.2150 3.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2280 -6.7970 2.5070 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.6010 -7.3580 -0.6970 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4060 -6.8340 -1.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0220 -6.6490 -2.3910 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.6090 -7.7840 -1.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5840 -6.8910 -1.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5770 -7.3140 -2.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6000 -8.6240 -3.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6300 -9.5160 -2.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6320 -9.0970 -2.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5710 -10.0670 -1.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6360 -6.3460 -3.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -2.4150 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 -2.4250 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3580 -2.2420 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3750 -2.2320 -0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3170 -4.4740 -0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3000 -4.4840 0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3260 -8.5650 3.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9320 -8.4170 5.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8190 -7.5150 6.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0690 -6.7500 5.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1510 -6.2720 -2.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6220 -6.8960 -3.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5670 -5.8680 -1.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3770 -8.9530 -3.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6510 -10.5380 -3.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9000 -10.5660 -0.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4020 -10.8110 -2.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6440 -9.5280 -1.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3050 -5.8530 -4.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5620 -6.8860 -3.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8070 -5.5990 -2.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 6 43 1 0 0 0 0 6 44 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 22 2 0 0 0 0 11 12 1 0 0 0 0 11 20 2 0 0 0 0 12 13 2 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 17 18 2 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 18 48 1 0 0 0 0 19 20 1 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 23 49 1 0 0 0 0 23 50 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 51 1 0 0 0 0 26 27 1 0 0 0 0 26 31 1 0 0 0 0 27 28 2 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 31 59 1 0 0 0 0 M END