CHEMBRIDGE-ZINC04947855 MOE2007 3D CORINA 3.40 0006 02.08.2006 68 68 0 0 0 0 0 0 0 0999 V2000 -2.4630 0.8490 2.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7520 -0.4860 2.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1540 -0.4230 0.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1920 -0.4520 -0.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3570 -2.5640 1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7620 -3.1450 1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7260 -4.6700 1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0560 -5.2380 1.1730 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8660 -5.2230 2.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5170 -4.7760 3.3820 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2140 -5.8080 2.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7970 -6.4380 3.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0680 -7.0050 3.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7600 -6.9430 1.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1940 -6.2800 0.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9210 -5.7120 0.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1020 -7.5580 1.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8160 -7.5860 2.8410 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.4650 -8.0930 0.6220 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.7640 -8.7000 0.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8590 -7.6470 0.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2290 -8.3070 0.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.5270 -7.7310 -0.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.2710 -7.6300 -2.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.6980 -6.7080 1.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.2010 -5.2790 1.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7290 1.2280 3.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8380 1.6040 1.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3870 0.7480 1.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8170 -0.4070 3.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4090 -1.1980 3.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7020 -0.9720 1.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1000 0.6160 1.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0640 0.0890 -1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7050 0.0290 -1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2260 -1.4720 -1.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8490 -2.8670 2.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7520 -2.8860 0.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4100 -2.7510 1.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2170 -2.8360 0.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1770 -5.0840 0.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2280 -4.9980 2.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3770 -5.6690 0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2630 -6.4970 4.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5110 -7.4980 3.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7360 -6.1630 -0.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5170 -5.1740 0.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8140 -8.0890 -0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6980 -9.3280 -0.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9770 -9.3480 1.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8340 -6.9540 1.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6570 -7.0450 -0.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.2710 -8.9180 -0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.4670 -8.9430 1.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.3780 -7.0970 -0.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.7380 -8.7570 -0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.1610 -7.9490 -2.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.0470 -6.5990 -2.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.4390 -8.2630 -2.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.8080 -6.7280 2.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.4490 -7.3820 1.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.1030 -5.2080 0.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.4430 -4.8890 2.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.4380 -4.6280 0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4210 -1.0420 1.2340 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.1940 -0.7740 0.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.3140 -7.2410 0.0520 N 0 3 0 0 0 0 0 0 0 0 0 0 -14.9170 -6.4510 -0.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 2 65 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 65 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 5 65 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 7 42 1 0 0 0 0 8 9 1 0 0 0 0 8 43 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 16 2 0 0 0 0 12 13 2 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 45 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 16 47 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 21 22 1 0 0 0 0 21 51 1 0 0 0 0 21 52 1 0 0 0 0 22 53 1 0 0 0 0 22 54 1 0 0 0 0 22 67 1 0 0 0 0 23 24 1 0 0 0 0 23 55 1 0 0 0 0 23 56 1 0 0 0 0 23 67 1 0 0 0 0 24 57 1 0 0 0 0 24 58 1 0 0 0 0 24 59 1 0 0 0 0 25 26 1 0 0 0 0 25 60 1 0 0 0 0 25 61 1 0 0 0 0 25 67 1 0 0 0 0 26 62 1 0 0 0 0 26 63 1 0 0 0 0 26 64 1 0 0 0 0 65 66 1 0 0 0 0 67 68 1 0 0 0 0 M CHG 1 65 1 M CHG 1 67 1 M END