CHEMDIV-ZINC04169879 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 37 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 -2.0240 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4790 -2.6650 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 -1.9270 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5960 -0.5450 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 0.1010 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2070 -2.7480 0.0370 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.1490 -1.8260 -0.4940 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9840 -4.0380 -0.5170 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6520 -3.0000 1.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7670 -2.3620 2.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1290 -2.5260 3.5040 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9840 -3.9820 2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4420 -3.3180 4.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8420 -3.4850 5.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1250 -4.2980 6.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9950 -4.9710 6.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5780 -4.8330 4.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2940 -4.0040 3.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8970 -3.8390 2.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8080 -4.4790 2.0320 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3430 -2.6010 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5220 -3.7440 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5100 0.0290 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3340 1.1800 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3510 -1.7120 1.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7150 -2.9700 6.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4360 -4.4230 7.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4430 -5.6090 6.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7010 -5.3590 4.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 30 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 22 2 0 0 0 0 13 14 2 0 0 0 0 13 31 1 0 0 0 0 14 16 1 0 0 0 0 15 23 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 19 20 2 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 M END