NCID-ZINC05004774 MOE2007 3D CORINA 3.40 0006 02.08.2006 68 71 0 0 1 0 0 0 0 0999 V2000 -0.1240 0.4800 -0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0440 0.8580 -1.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6600 0.6520 -2.5750 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2460 1.3990 -1.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2510 0.9770 -3.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6330 1.7230 0.3830 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8060 0.8680 0.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0320 1.0420 0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1110 0.2610 0.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9640 -0.7000 1.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7280 -0.8750 2.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6500 -0.0920 1.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8410 -1.8700 3.0810 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0480 -2.5790 2.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8510 -1.5850 2.0760 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0200 3.2000 0.4820 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8530 3.4030 -0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4270 3.5180 1.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6200 3.9750 2.6700 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8430 3.2670 2.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8400 4.0540 0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7940 3.5340 -0.2290 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9490 5.3980 0.1080 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8030 6.2290 -0.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1830 7.6840 -0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9960 8.3690 1.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3450 9.7040 1.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8810 10.3530 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0680 9.6680 -1.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7140 8.3340 -1.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1490 1.6660 -2.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2820 2.8030 -2.5120 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8600 0.6610 -2.6450 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7200 0.9190 -3.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4000 -0.3600 -4.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6250 -0.7000 -3.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2480 -1.8740 -4.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6470 -2.7070 -4.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4220 -2.3660 -5.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8010 -1.1910 -5.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3780 -0.5180 0.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9080 0.4890 -0.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2370 1.1970 0.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7900 1.5220 1.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1490 1.7910 -0.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0680 0.3990 0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6900 -0.2290 2.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8280 -3.4060 2.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5480 -2.9380 3.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9230 2.2550 2.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1100 3.9840 3.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5200 3.3780 1.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7860 5.8140 0.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 6.0250 0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5080 5.9980 -1.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5770 7.8620 1.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 10.2390 2.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1550 11.3950 0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4870 10.1750 -2.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8570 7.8000 -2.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8030 -0.2330 -2.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4740 1.6610 -3.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1160 1.2940 -4.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0950 -0.0500 -2.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2050 -2.1400 -3.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1330 -3.6240 -5.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9520 -3.0180 -6.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8460 -0.9230 -5.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 3 5 1 0 0 0 0 4 6 1 0 0 0 0 4 31 1 0 0 0 0 6 7 1 0 0 0 0 6 16 1 0 0 0 0 6 44 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 45 1 0 0 0 0 9 10 1 0 0 0 0 9 46 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 47 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 48 1 0 0 0 0 14 49 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 21 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 50 1 0 0 0 0 20 51 1 0 0 0 0 20 52 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 53 1 0 0 0 0 24 25 1 0 0 0 0 24 54 1 0 0 0 0 24 55 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 56 1 0 0 0 0 27 28 1 0 0 0 0 27 57 1 0 0 0 0 28 29 2 0 0 0 0 28 58 1 0 0 0 0 29 30 1 0 0 0 0 29 59 1 0 0 0 0 30 60 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 33 34 1 0 0 0 0 33 61 1 0 0 0 0 34 35 1 0 0 0 0 34 62 1 0 0 0 0 34 63 1 0 0 0 0 35 36 1 0 0 0 0 35 40 2 0 0 0 0 36 37 2 0 0 0 0 36 64 1 0 0 0 0 37 38 1 0 0 0 0 37 65 1 0 0 0 0 38 39 2 0 0 0 0 38 66 1 0 0 0 0 39 40 1 0 0 0 0 39 67 1 0 0 0 0 40 68 1 0 0 0 0 M END