IBS-ZINC04023863 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 1 0 0 0 0 0999 V2000 -1.6930 1.1370 1.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5540 -0.2840 1.2290 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5990 -0.8420 2.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4100 -2.2160 2.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5620 -2.7810 2.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3460 -1.9780 3.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1590 -0.6080 3.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1930 -0.0380 2.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4050 -2.5970 4.5010 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4040 -3.6780 4.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7750 -2.0350 4.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -0.6020 4.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4960 0.2030 3.9230 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2490 -0.2130 5.7050 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5490 -1.1100 6.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1150 -2.2730 5.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3910 -3.2010 6.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0250 -4.2420 6.2070 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0600 -2.9240 8.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9620 -1.4090 8.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2820 -0.7700 7.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3220 1.1240 6.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2840 1.9960 5.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3520 3.3150 6.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4650 3.7770 6.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5060 2.8960 7.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4290 1.5780 6.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5420 5.1890 7.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6370 5.9530 7.0380 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7550 1.6060 0.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4880 1.4510 0.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9410 1.4380 2.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0220 -2.8440 1.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7090 -3.8510 2.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7720 0.0170 4.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 1.0330 2.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5570 -2.6210 4.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8980 -2.0800 3.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1070 -3.3890 8.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8450 -3.3290 8.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1440 -1.0100 7.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7870 -1.1940 9.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0950 -1.1500 8.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2170 0.3120 8.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4240 1.6390 5.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5460 3.9930 5.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3680 3.2490 7.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2310 0.8960 7.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6170 5.6320 7.9900 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6220 6.5650 8.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 16 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 22 1 0 0 0 0 15 16 2 0 0 0 0 15 21 1 0 0 0 0 16 17 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 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 48 1 0 0 0 0 28 29 2 0 0 0 0 28 49 1 0 0 0 0 49 50 1 0 0 0 0 M END