IBS-ZINC06664103 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 62 0 0 1 0 0 0 0 0999 V2000 0.6180 1.3320 0.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0750 0.1150 -0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6090 -0.4510 -1.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5670 -1.1950 -1.3020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 -0.0240 -2.4700 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 -0.5350 -3.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 0.6530 -4.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1980 1.6040 -4.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5900 2.1340 -3.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0050 0.9580 -2.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1700 2.7550 -5.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2460 2.8550 -6.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2690 4.0080 -7.4480 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1450 4.3540 -8.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9890 4.5820 -6.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9220 3.8230 -5.3920 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1170 1.8260 -7.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0840 0.5490 -6.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2680 -1.0100 1.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 -1.1140 2.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5090 -0.3740 2.2050 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2820 -2.1280 3.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 -2.9820 3.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0960 -3.9210 3.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2570 -4.0510 5.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5130 -5.0160 6.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3160 -5.1170 7.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4200 -4.2770 7.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7000 -3.3310 6.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 -3.1960 5.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1230 -2.2270 4.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6930 1.2100 0.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4310 2.0770 -0.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1700 1.6610 1.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4710 -1.1630 -3.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1780 -1.1180 -4.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8320 1.1800 -4.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2790 0.2920 -5.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2590 2.6530 -2.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4270 2.8260 -3.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9080 0.4920 -2.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1900 1.3160 -1.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5290 5.5150 -6.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1400 2.1960 -7.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7330 1.6120 -8.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8510 -0.1410 -7.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1050 0.0790 -6.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0320 -1.6000 0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4770 -2.8890 2.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9520 -4.5700 3.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3640 -5.6740 5.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 -5.8600 7.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0620 -4.3790 8.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5590 -2.6870 6.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9720 -1.5660 4.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3370 0.8900 -5.3600 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5680 0.0660 -4.8250 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 20 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 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 9 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 57 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 19 57 1 0 0 0 0 20 21 1 0 0 0 0 20 49 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 32 2 0 0 0 0 24 25 2 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 29 30 2 0 0 0 0 29 54 1 0 0 0 0 30 31 1 0 0 0 0 30 55 1 0 0 0 0 31 32 1 0 0 0 0 32 56 1 0 0 0 0 57 58 1 0 0 0 0 M END