CHEMBRIDGE-ZINC04247907 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 61 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7020 1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0840 1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7720 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0790 -1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6920 -1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 -0.0080 -2.3770 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2290 0.3360 -2.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9990 1.0970 -4.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3590 2.3430 -3.9830 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0980 3.1360 -5.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5850 4.4400 -4.7260 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4790 4.2120 -4.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9770 5.2320 -5.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8110 7.3780 -6.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4230 8.6990 -6.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7090 8.4330 -5.5970 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5310 7.5390 -4.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9190 6.2180 -4.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3290 9.6180 -5.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5630 9.5750 -4.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1690 10.7610 -4.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5190 11.9550 -4.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2960 11.9240 -5.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3140 5.2160 -3.9320 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.8290 -2.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1670 2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6280 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -3.8520 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7870 0.9650 -2.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7950 -0.5730 -3.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9570 1.2810 -4.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3660 0.5030 -4.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0370 3.3630 -5.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5540 2.5850 -5.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 5.4600 -6.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6640 4.6400 -6.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4750 6.9080 -7.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8430 7.5700 -7.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7460 9.1820 -5.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5820 9.3530 -7.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8670 8.0090 -3.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4990 7.3470 -3.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7600 5.5650 -4.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5960 5.7340 -5.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0410 8.6290 -4.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1270 10.7600 -3.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9660 12.8990 -4.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7870 12.8500 -5.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1340 5.4560 -4.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0120 -3.0240 -2.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5150 -2.2320 -3.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 -3.7750 -2.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6330 6.4840 -5.5740 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7390 10.7760 -5.4670 N 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 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 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 10 37 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 26 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 15 58 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 16 58 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 20 58 1 0 0 0 0 21 22 1 0 0 0 0 21 59 2 0 0 0 0 22 23 2 0 0 0 0 22 50 1 0 0 0 0 23 24 1 0 0 0 0 23 51 1 0 0 0 0 24 25 2 0 0 0 0 24 52 1 0 0 0 0 25 53 1 0 0 0 0 25 59 1 0 0 0 0 26 54 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 27 57 1 0 0 0 0 M END