IBS-ZINC02250575 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 1 0 0 0 0 0999 V2000 1.9350 -3.0310 -0.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8530 -1.9890 -0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4500 -2.6300 -0.2330 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 -1.8450 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3660 -0.6580 0.2160 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8730 -2.4270 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9830 -1.6140 0.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2460 -2.1600 0.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4190 -3.5210 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3160 -4.3330 -0.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0510 -3.7920 -0.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6980 -4.0700 0.0450 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.9040 -3.2300 0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9490 -3.7230 -0.8370 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.5280 -3.6920 -1.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3540 -5.1620 -0.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1430 -5.9660 -0.3150 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.9060 -5.4340 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0250 -6.4030 0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.6240 -7.5710 -0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9860 -7.3250 -0.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8790 -8.3940 -0.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0660 -8.2080 -0.7690 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3480 -9.6420 -0.5310 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.9340 -10.4010 -0.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0450 -9.8660 -0.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6500 -11.0160 -0.2940 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1480 -8.8740 -0.1180 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7320 -9.1660 0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1010 -2.8790 -0.7780 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9130 -2.5500 -0.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9080 -3.8060 0.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7550 -3.4800 -1.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0330 -1.5400 0.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8800 -1.2140 -0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8500 -0.5590 0.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1040 -1.5330 0.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4540 -5.3880 -0.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1960 -4.4220 -0.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3030 -3.3110 1.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6500 -2.1920 -0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9390 -5.1690 0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9470 -5.5760 -1.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5600 -9.2920 1.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4580 -10.0830 -0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1240 -8.3420 -0.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9200 -1.9520 -0.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 18 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 30 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 28 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 29 44 1 0 0 0 0 29 45 1 0 0 0 0 29 46 1 0 0 0 0 30 47 1 0 0 0 0 M END