IBS-ZINC02131640 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 0.1670 1.3680 -0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -0.1550 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8750 -0.6710 1.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4260 -0.5340 0.1380 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8140 -0.0130 1.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2270 -0.1400 -1.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4920 -0.9670 -1.9220 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6480 1.1320 -1.2210 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5000 1.7760 -0.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3310 1.5420 -2.4510 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.9420 0.7170 -2.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2250 2.7480 -2.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3240 2.3430 -1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1310 2.4480 0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1380 2.0760 1.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3380 1.5990 0.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5300 1.4940 -0.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5250 1.8700 -1.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3080 1.9140 -3.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1300 1.8450 -3.2350 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5320 -1.9810 0.3440 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1050 -2.8310 -0.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1660 -4.1240 -0.5190 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6680 -4.7230 0.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7320 -6.1130 0.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 -6.6790 1.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7090 -5.8840 2.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6560 -4.5100 2.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1350 -3.9180 1.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0480 -2.4580 1.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4290 -1.7070 2.3800 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 1.6440 -0.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3280 1.7240 -1.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3030 1.8200 0.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4020 -0.6010 -1.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5140 -0.2250 2.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 -1.7560 1.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9200 -0.4010 0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6300 3.5420 -1.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6640 3.1080 -3.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1940 2.8220 0.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9880 2.1580 2.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1250 1.3080 1.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4670 1.1210 -1.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6760 1.7920 -2.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6950 -2.4110 -1.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3790 -6.7420 -0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2990 -7.7540 1.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1110 -6.3460 3.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0150 -3.8970 3.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7060 2.3230 -4.7080 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0130 2.5510 -5.3430 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 4 1 0 0 0 0 2 35 1 0 0 0 0 3 36 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 6 1 0 0 0 0 4 21 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 19 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 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 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 16 17 2 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 18 45 1 0 0 0 0 19 20 2 0 0 0 0 19 51 1 0 0 0 0 21 22 1 0 0 0 0 21 30 1 0 0 0 0 22 23 2 0 0 0 0 22 46 1 0 0 0 0 23 24 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 30 1 0 0 0 0 30 31 2 0 0 0 0 51 52 1 0 0 0 0 M END