IBS-ZINC04084870 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 1 0 0 0 0 0999 V2000 0.0540 1.7380 0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 0.2240 0.2840 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7130 -0.2520 -0.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4270 -0.1060 1.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5080 -0.6350 2.4310 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3280 -0.3070 0.0060 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9120 -0.3960 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3700 -0.0340 -2.2780 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3100 -1.0000 -1.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8990 -1.0570 -2.4620 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1580 -1.5880 -2.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9210 -2.0790 -1.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2030 -2.6050 -1.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6780 -2.6210 -2.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9370 -2.1390 -4.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6750 -1.6190 -3.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5980 -2.2500 -5.2340 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.8240 -2.8340 -4.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7950 -3.1220 -5.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7500 -2.8820 -7.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6080 -3.1270 -8.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6270 -2.9160 -9.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7860 -2.4730 -10.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9330 -2.2430 -9.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9150 -2.4520 -7.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6680 -2.3110 -11.3980 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.8270 -1.8790 -12.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9370 -3.0920 -3.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8630 -3.5840 -2.8620 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0570 2.1330 0.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2280 2.0340 -0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6390 2.2300 0.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7860 -0.6380 0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2100 -2.0090 -0.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9110 -0.3670 -0.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5390 -2.0640 -0.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7960 -2.9850 -0.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0960 -1.2440 -4.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7230 -3.5540 -5.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6920 -3.4910 -7.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7280 -3.1060 -9.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8590 -1.9020 -9.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8240 -2.2660 -7.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1440 -0.8860 -11.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5690 -1.8060 -13.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6400 -2.6060 -12.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6140 0.1740 2.0710 O 0 5 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 2 4 1 0 0 0 0 2 6 1 0 0 0 0 4 5 2 0 0 0 0 4 47 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 14 28 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 28 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 28 29 2 0 0 0 0 M CHG 1 47 -1 M END