IBS-ZINC02233531 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 0 0 0 0 0 0999 V2000 0.1590 2.4920 1.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4220 0.9980 1.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0130 0.7730 3.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8940 0.2270 1.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4140 0.3490 0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0360 -0.5890 -0.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5150 -0.4760 -2.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3700 0.5880 -2.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7070 1.4990 -1.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5500 2.5610 -1.6410 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8460 3.8430 -1.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7550 4.9760 -1.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0340 4.8910 -1.2740 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7340 3.5970 -1.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7470 2.5180 -0.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5520 5.9700 -0.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9990 7.0480 -0.7470 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7940 5.8420 0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9230 6.5190 1.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0840 6.3960 2.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1180 5.6020 1.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9960 4.9280 0.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8430 5.0470 -0.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8910 0.7480 -3.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3040 0.8740 -4.7550 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9750 -1.6020 -2.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4660 -2.6570 -1.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1390 -1.8020 -0.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0960 3.0410 1.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2620 2.6520 0.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5430 2.8450 2.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 0.6450 0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3110 1.1270 3.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -0.2910 3.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9500 1.3220 3.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7230 -0.8230 1.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6250 0.6400 2.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5880 4.0080 -0.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9360 3.8220 -2.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2830 5.9370 -1.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9290 4.8700 -3.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5710 3.6470 -0.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0990 3.3590 -2.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2160 1.5380 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4630 2.7020 0.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1160 7.1380 1.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1850 6.9190 3.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0250 5.5080 2.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8080 4.3100 0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7510 4.5240 -1.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7670 -2.0210 -3.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1550 -1.2450 -3.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2450 -3.3860 -1.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4300 -3.1510 -2.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9080 -1.4990 -0.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3600 -2.3580 0.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2240 1.3430 -0.1410 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 57 2 0 0 0 0 6 7 2 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 8 9 2 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 9 57 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 21 22 2 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 23 50 1 0 0 0 0 24 25 3 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 M END