IBS-ZINC05485115 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 56 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7800 1.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.1710 0.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -3.4080 1.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -4.5590 0.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -4.5080 -0.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -3.2990 -1.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -2.1140 -0.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -0.7840 -1.1220 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -0.4480 -2.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -0.3110 2.5290 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7210 1.0280 2.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0030 1.4480 2.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3580 2.7690 2.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4210 3.6640 3.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1360 3.2460 3.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2280 1.9170 3.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4440 1.2630 3.3320 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3800 -0.0390 3.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2840 -0.8450 3.0790 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6510 1.9190 3.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4660 2.4670 2.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9360 1.3820 1.8650 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6820 1.6980 0.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1700 0.6940 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9290 1.0180 -1.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2010 2.3420 -1.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7150 3.3450 -0.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9610 3.0260 0.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6680 -1.2760 3.3680 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0710 -3.4550 2.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 -5.5150 1.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -5.4260 -1.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -3.2700 -2.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7320 0.7460 1.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3630 3.1010 2.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6980 4.6950 3.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5890 3.9510 3.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2510 1.1970 4.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3680 2.7390 4.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3170 3.0320 3.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8380 3.1210 2.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9570 -0.3410 0.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3090 0.2360 -1.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7940 2.5940 -2.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9290 4.3790 -0.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5860 3.8090 1.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7020 -1.0260 4.3010 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 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 12 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 12 20 1 0 0 0 0 12 31 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 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 2 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 29 2 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 31 52 1 0 0 0 0 M END