IBS-ZINC04871641 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 0.4540 -0.5510 1.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2080 -0.0410 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6630 -0.4060 -1.2160 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6530 0.0330 -1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7900 -1.9280 -1.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6450 -2.2900 -2.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 -1.6960 -3.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8720 -0.1810 -3.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2190 1.5530 -2.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1800 1.9730 -3.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6030 1.1540 -4.2000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5690 3.2600 -3.5070 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0680 4.2720 -2.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2310 5.3020 -3.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9710 5.7020 -4.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9780 4.9860 -5.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4140 5.6940 -6.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4050 5.4310 -7.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5450 6.3430 -8.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7490 7.4730 -8.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7620 7.7570 -7.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5970 6.8500 -6.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7390 6.8220 -5.3410 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 7.4940 -5.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5980 6.1060 -9.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5030 3.6950 -4.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4770 -1.6410 1.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4730 -0.1670 1.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1150 -0.2090 2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1900 -0.5010 -0.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3170 1.0420 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2630 -2.3120 -0.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2010 -2.3700 -1.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6480 -1.8810 -2.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7020 -3.3740 -2.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6320 -1.9140 -4.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.1340 -3.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8610 0.2580 -3.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4040 0.2430 -4.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7150 2.1030 -2.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 1.7680 -1.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9100 4.7710 -2.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4490 3.7900 -1.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 6.1800 -2.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7300 4.8640 -3.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0300 4.5530 -7.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9040 8.1550 -9.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1480 8.6420 -7.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5330 6.5730 -9.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2720 6.5390 -10.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7520 5.0340 -9.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5550 2.9390 -5.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4930 3.8580 -4.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 0.1120 -2.4430 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 54 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 8 54 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 9 41 1 0 0 0 0 9 54 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 26 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 16 2 0 0 0 0 15 23 1 0 0 0 0 16 17 1 0 0 0 0 16 26 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 25 1 0 0 0 0 20 21 2 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 M END