IBS-ZINC02155354 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 0 0 1 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 0.7420 -0.5110 1.2420 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 -1.4160 -2.0580 -0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7560 -2.5520 -0.1110 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9180 -3.8950 -0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1960 -4.4420 -0.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3650 -5.8040 -0.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2500 -6.6360 -0.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9660 -6.0830 -0.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8060 -4.7200 -0.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4260 -8.0970 -0.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5430 -8.5770 -0.5680 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3480 -8.8990 -0.6840 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5240 -10.3480 -0.8040 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4260 -10.5590 -1.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3120 -10.9510 -1.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2560 -10.4380 -2.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7530 -11.0450 -4.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5150 -10.2800 -5.1330 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7810 -10.5110 -6.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8430 -9.1330 -4.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6560 -9.1780 -3.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -8.1320 -2.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4560 -7.0650 -3.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2720 -7.0130 -4.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3670 -8.0390 -5.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6500 -10.9540 0.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5990 -10.2480 1.5490 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8190 -12.2790 0.7060 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9330 -12.7930 2.0590 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 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9160 -0.2570 0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9860 -0.1020 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9330 -2.3340 -1.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8630 -2.4890 0.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0580 -3.7970 -0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3590 -6.2270 -0.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1020 -6.7240 -0.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8150 -4.2910 -0.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4570 -8.5160 -0.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4010 -10.6650 -0.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4000 -12.0370 -1.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2640 -11.9960 -4.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1470 -8.1640 -1.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9630 -6.2550 -2.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6380 -6.1640 -5.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5070 -7.9890 -6.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0270 -12.5550 2.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7920 -12.3360 2.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0660 -13.8740 2.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 36 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 44 1 0 0 0 0 9 10 1 0 0 0 0 9 45 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 46 1 0 0 0 0 12 47 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 48 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 29 1 0 0 0 0 18 19 1 0 0 0 0 18 49 1 0 0 0 0 18 50 1 0 0 0 0 19 20 2 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 51 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 26 27 2 0 0 0 0 26 53 1 0 0 0 0 27 28 1 0 0 0 0 27 54 1 0 0 0 0 28 55 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 32 1 0 0 0 0 32 56 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 M END