CHEMDIV-ZINC05143795 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 1.1100 1.9600 -0.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0430 0.4380 -0.4550 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0150 0.1380 -0.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9420 -0.0070 0.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7790 -1.5120 0.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6650 -1.9500 2.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1810 -1.9410 3.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9940 -2.3430 4.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2890 -2.7550 4.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7720 -2.7650 2.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9580 -2.3670 1.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4980 -0.1880 -1.6980 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6340 -0.3740 -2.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5210 -0.0220 -2.6020 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1030 -1.0190 -3.9950 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4780 -2.0200 -3.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2230 -0.1770 -4.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 -1.1070 -4.9360 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7220 -0.0580 -5.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6770 -0.5250 -6.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5660 -1.9170 -6.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5200 -2.2680 -5.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 -3.6260 -5.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -3.8190 -4.3590 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5720 -4.7620 -6.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9690 -4.5770 -7.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4660 -5.6410 -8.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5720 -6.8900 -7.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1810 -7.0810 -6.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6760 -6.0260 -5.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1380 2.2610 -0.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4700 2.2770 -1.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7710 2.4270 0.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9810 0.2140 0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6590 0.5270 1.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 -1.7330 1.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0620 -2.0460 0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 -1.6190 3.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6160 -2.3350 5.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9240 -3.0680 4.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7840 -3.0860 2.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3340 -2.3780 0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4220 -0.4700 -1.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0550 -0.1120 -3.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5620 -0.6430 -5.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8490 0.8240 -4.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5530 0.9800 -5.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3950 0.0730 -6.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1810 -2.5920 -6.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8880 -3.6020 -7.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7740 -5.4990 -9.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9630 -7.7200 -8.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2670 -8.0580 -5.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3660 -6.1780 -4.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 12 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 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 11 2 0 0 0 0 7 8 2 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 9 10 2 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 43 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 17 1 0 0 0 0 15 18 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 19 20 2 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 21 22 2 0 0 0 0 21 49 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 29 2 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 29 53 1 0 0 0 0 30 54 1 0 0 0 0 M END