CHEMDIV-ZINC06901459 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3740 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 1.2180 -0.6780 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4160 0.0600 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4990 -0.9260 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9260 -2.1390 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5630 -2.0110 -0.0240 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 -3.1260 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1800 -3.4210 -1.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6210 -2.7640 -2.3530 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6980 -4.4140 -1.6760 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1360 -4.7210 -3.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9660 -6.2260 -3.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6180 -6.9440 -2.2340 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0710 -6.7060 -0.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2420 -5.2290 -0.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3740 1.4560 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 2.0980 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1150 3.8590 0.0120 S 0 0 0 0 0 0 0 0 0 0 0 0 2.3470 4.3000 -0.5420 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 4.2260 -0.5180 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1160 4.3400 1.5970 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3790 4.5960 2.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3290 6.0000 2.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0830 6.1270 3.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1700 5.9260 2.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1480 4.5260 2.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 1.8950 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -0.5580 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5590 -0.7160 -0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4600 -3.0780 -0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0910 -4.0090 0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2570 -2.8600 0.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1840 -4.4460 -3.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5260 -4.1650 -3.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 -6.4960 -4.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 -6.4750 -3.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5930 -7.3210 -0.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 -6.9570 -0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7030 -5.0100 0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3010 -5.0060 -0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2910 2.0260 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5120 3.8580 3.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2090 4.5320 1.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2200 6.1660 3.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2880 6.7420 2.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1130 5.3690 4.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0580 7.1170 4.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0580 6.0400 3.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1870 6.6680 2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9850 4.4170 1.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2260 3.7830 3.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 1 0 0 0 0 4 17 2 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 40 1 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 2 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 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 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 M END