CHEMDIV-ZINC06875259 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 56 0 0 1 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -0.4990 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4990 -1.7570 -0.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9650 -2.1870 -0.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1370 -3.5340 -1.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5410 -3.9460 -1.2090 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9300 -5.1100 -1.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1180 -5.8160 -2.3260 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3750 -5.5330 -1.6960 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.9980 -4.7850 -2.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7960 -5.6670 -0.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2930 -5.9750 -0.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7920 -6.1330 1.5800 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.1460 -7.2700 2.1350 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6360 -4.8700 2.2130 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.5640 -6.4900 1.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5390 -6.8240 -2.3700 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.4050 -7.0790 -3.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2410 -8.5400 -3.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7860 -9.3520 -4.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4340 -10.6900 -4.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5350 -11.2140 -3.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9830 -10.4090 -3.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3320 -9.0580 -2.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9170 -7.9670 -2.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1270 -8.0860 -1.1190 O 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 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1990 -1.6620 -1.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8760 -2.5050 -0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2650 -2.2820 0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5880 -1.4390 -1.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8370 -3.4400 -2.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5140 -4.2830 -0.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1910 -3.3820 -0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2350 -6.4760 0.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5900 -4.7330 0.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8540 -5.1650 -0.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4980 -6.9080 -0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7020 -7.4080 0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9960 -6.6100 2.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0580 -5.6650 0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4430 -6.8670 -3.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0930 -6.4640 -4.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4890 -8.9460 -5.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8630 -11.3270 -5.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2650 -12.2580 -4.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2820 -10.8220 -2.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 8 42 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 19 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 15 16 2 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 19 20 1 0 0 0 0 19 27 1 0 0 0 0 20 21 1 0 0 0 0 20 50 1 0 0 0 0 20 51 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 52 1 0 0 0 0 23 24 1 0 0 0 0 23 53 1 0 0 0 0 24 25 2 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 M END