CHEMDIV-ZINC06996658 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 49 0 0 0 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 -1.3720 -0.5110 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1100 -0.6540 -1.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7780 -1.9830 -1.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5360 -3.0990 -1.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2340 -4.3180 -2.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1680 -4.4220 -3.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4090 -3.3010 -3.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7190 -2.0830 -2.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8680 -5.6200 -3.5950 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 -5.6530 -4.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0920 -0.9230 1.4460 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.1200 -1.8510 1.1270 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0390 -1.2110 2.3560 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8980 0.5200 2.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1180 0.8770 1.8100 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5120 1.9500 2.3450 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6690 2.5970 3.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1900 1.7330 3.1250 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.9260 3.7900 3.7580 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1380 4.3710 3.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0040 3.8540 2.9850 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4160 5.6650 4.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4470 6.7420 3.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8540 6.1060 4.0990 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 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1800 -0.6040 -1.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8280 0.1500 -1.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3650 -3.0170 -0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8260 -5.1890 -1.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4210 -3.3800 -4.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1320 -1.2090 -2.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -4.9740 -5.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 -5.3440 -3.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3710 -6.6660 -4.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2330 4.2050 4.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2830 5.5180 5.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4230 6.4280 4.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5800 6.8880 2.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6490 7.6770 4.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5440 5.3380 4.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0550 7.0410 4.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9870 6.2520 3.0270 H 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 13 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 M END