IBS-ZINC00056759 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 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 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1870 -0.0730 -1.2070 C 0 0 3 0 0 0 0 0 0 0 0 0 2.2490 1.0060 -1.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8630 -0.4510 -2.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8050 -1.2080 -2.4910 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8540 -0.7500 -0.0920 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9490 -0.2020 0.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3830 0.8510 0.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6350 -0.8980 1.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8240 -0.0850 2.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0960 -0.2500 1.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8980 0.6740 2.2790 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8560 0.7520 2.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1430 1.4760 3.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8090 1.0400 2.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8070 1.6820 3.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1270 2.7330 4.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4400 3.1700 4.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4460 2.5460 3.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 -1.6240 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 -1.5840 -1.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2440 -0.0640 -2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5070 -1.5920 0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9370 -1.0030 2.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9690 -1.8850 1.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4360 -1.0010 0.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7830 1.3480 3.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3510 3.2290 5.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6780 4.0020 5.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4650 2.8940 4.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4190 0.0530 -3.6620 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8850 -0.2180 -4.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 40 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 39 1 0 0 0 0 40 41 1 0 0 0 0 M END