NCID-ZINC05478981 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 55 0 0 1 0 0 0 0 0999 V2000 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 1.5850 -1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1330 1.8000 -2.2340 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2300 1.8160 -1.1600 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5060 2.1800 -0.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6230 2.8540 -2.2140 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3460 2.4890 -3.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1110 3.0840 -2.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8900 2.8300 -3.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2540 3.0420 -3.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8430 3.5070 -2.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0630 3.7610 -0.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6980 3.5440 -0.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8000 4.3450 0.5100 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -8.5570 3.7730 -2.0060 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.7570 4.4120 -1.8790 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.2220 5.4490 -3.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5610 6.8220 -3.1590 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4770 6.7030 -3.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9470 7.6830 -4.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8220 8.5080 -4.2160 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9490 0.5210 -1.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2390 0.2220 -2.5710 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3060 -0.4020 -0.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0250 -1.6350 -0.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4540 -2.7460 0.5170 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.2830 -4.1240 -0.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7150 -5.1650 0.7140 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.4020 -4.7070 1.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4040 -6.3100 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7990 -7.3320 -0.2070 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5230 1.4370 0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4310 2.4670 -4.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8620 2.8440 -4.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0900 3.7370 -0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8890 4.9740 -4.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3050 5.5680 -3.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0110 7.5830 -1.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3970 -0.7110 0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9610 0.1190 0.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9340 -1.3260 -1.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3690 -2.1560 -1.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1610 -3.7530 -0.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5960 -4.5830 -1.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7970 -6.3070 2.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3190 7.5330 -5.5100 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0090 7.4610 -1.9140 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7060 6.9360 -1.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6880 -6.1960 -0.3530 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5320 -5.6660 1.4280 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8800 -6.0960 0.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0870 -6.9570 -0.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6010 8.1080 -6.2350 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 4 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 22 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 16 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 37 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 49 1 0 0 0 0 20 21 2 0 0 0 0 20 48 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 41 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 52 1 0 0 0 0 30 31 2 0 0 0 0 30 51 1 0 0 0 0 40 49 1 0 0 0 0 47 52 1 0 0 0 0 48 55 1 0 0 0 0 49 50 1 0 0 0 0 51 54 1 0 0 0 0 52 53 1 0 0 0 0 M END