IBS-ZINC02335843 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 51 0 0 0 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 -0.7000 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0820 1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7700 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0690 -1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6880 -1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -4.1720 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9300 -5.0160 -0.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5020 -6.2440 -0.3000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6680 -6.2280 0.2320 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0630 -4.9870 0.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -4.4730 1.1130 S 0 0 0 0 0 0 0 0 0 0 0 0 3.3550 -6.0850 1.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7180 -5.8880 2.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9670 -5.7980 3.3800 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3100 -5.8490 4.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3280 -5.6220 3.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1660 -5.4700 4.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5210 -5.3100 4.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0520 -5.3000 3.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2430 -5.4490 2.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8660 -5.6130 2.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8280 -5.7850 1.3760 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2270 -4.6150 -1.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0120 -5.5330 -1.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2160 -5.1160 -2.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6300 -3.8720 -2.1440 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9210 -2.9760 -1.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7090 -3.3080 -0.9170 C 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 0.0250 -0.1640 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6250 2.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6020 -2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1410 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7270 -6.6520 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4540 -6.6330 0.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7580 -5.4760 5.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1740 -5.1910 5.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1160 -5.1740 3.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6660 -5.4400 1.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6800 -6.5520 -1.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8290 -5.8160 -2.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2990 -1.9690 -1.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1370 -2.5710 -0.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 2 0 0 0 0 9 25 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 24 2 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 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 44 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 28 29 2 0 0 0 0 29 30 1 0 0 0 0 29 46 1 0 0 0 0 30 47 1 0 0 0 0 M END