IBS-ZINC04729557 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 0 0 0 0 0 0999 V2000 -0.6050 1.9210 -0.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2640 0.4420 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 -0.3460 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0410 -0.8900 -1.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4590 -2.2830 -1.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1560 -0.5770 1.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6340 -0.0560 2.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2600 -0.2860 3.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4300 -1.0600 3.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0690 -1.3350 4.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1000 -2.2660 4.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4260 -2.9190 3.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9350 -4.0240 3.5260 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1420 -2.2520 2.4150 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9780 -1.5590 2.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3280 -1.3190 1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8350 -2.5870 6.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4760 -3.6040 6.7940 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3250 -4.3310 6.4600 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0080 -5.4450 7.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6680 -5.7690 8.1180 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8590 -6.2720 6.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5900 -7.4800 7.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5160 -8.2480 6.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7050 -7.8240 5.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9660 -6.6270 5.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0410 -5.8530 5.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0050 -1.7360 6.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3140 2.5070 -0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1340 2.0490 -1.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2380 2.2600 0.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3700 0.1040 -0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2650 0.3140 0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1270 -0.9580 -1.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7750 -0.2340 -2.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7260 -2.9390 -0.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8630 -2.6880 -2.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3740 -2.2150 -1.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7290 0.5320 2.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8550 0.1270 4.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7640 -0.8370 5.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7320 -1.7110 0.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7570 -4.0320 5.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2210 -7.8120 8.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3070 -9.1830 7.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1340 -8.4290 5.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3290 -6.3020 4.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2460 -4.9220 5.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9210 -2.1360 6.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0850 -1.7430 7.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8550 -0.7140 6.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 16 2 0 0 0 0 7 8 2 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 15 2 0 0 0 0 10 11 2 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 11 17 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 42 1 0 0 0 0 17 18 2 0 0 0 0 17 28 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 26 2 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 48 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 M END