CHEMDIV-ZINC06799583 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 0 0 0 0 0 0999 V2000 -0.9230 1.2780 1.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3620 -0.0370 0.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9060 -0.2060 0.3380 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3510 -1.4560 -0.0730 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5190 -2.5730 -0.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9490 -3.6660 -0.6220 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8700 -2.3190 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2820 -1.0720 0.4110 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6460 -1.0960 0.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0980 -2.3680 0.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9750 -3.1430 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7800 -1.5980 -0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0910 -1.6840 -1.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5420 -0.9850 -2.6400 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0790 -2.6100 -2.0990 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5140 -2.8530 -3.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9710 -4.3030 -3.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4840 -4.5670 -5.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1480 -2.1620 -5.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6330 -1.8860 -3.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2370 -3.9220 -6.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5740 -3.2610 -6.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7050 -3.7210 -6.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9390 -3.0890 -6.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0560 -1.9950 -7.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9410 -1.5320 -7.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7060 -2.1620 -7.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1190 2.0150 1.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6480 1.6450 0.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4050 1.1760 1.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1930 -0.2190 0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1260 -2.6990 0.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9680 -4.1870 -0.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3130 -0.7370 0.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1240 -2.5020 0.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5190 -3.1330 -1.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6550 -2.6800 -4.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7600 -4.5340 -2.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1400 -4.9840 -3.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8920 -5.5810 -5.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7020 -4.4340 -5.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3740 -2.0030 -6.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0080 -1.5190 -5.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2740 -0.8510 -3.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4600 -1.9640 -3.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5170 -3.6410 -7.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3700 -5.0100 -6.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6420 -4.5790 -5.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8110 -3.4520 -5.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0180 -1.5040 -7.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0340 -0.6790 -8.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8510 -1.7820 -8.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6010 -3.6030 -5.3600 N 0 3 0 0 0 0 0 0 0 0 0 0 7.3400 -3.7370 -4.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 8 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 12 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 11 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 33 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 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 16 37 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 40 1 0 0 0 0 18 41 1 0 0 0 0 18 53 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 19 53 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 21 53 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 26 2 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END