IBS-ZINC05452186 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 0 0 0 0 0 0999 V2000 0.2650 1.5270 0.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2740 0.1470 0.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4630 -0.5440 0.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6420 0.1460 0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6320 1.5260 0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4440 2.2170 0.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9380 -0.6080 0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1640 -0.9360 -1.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4240 -1.6680 -1.5650 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6360 -1.1320 -1.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5380 -2.0680 -1.9240 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9660 -3.2710 -1.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6030 -3.0310 -1.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7550 -4.0860 -1.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2530 -5.3680 -1.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6050 -5.6150 -1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4600 -4.5760 -1.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0980 -6.9230 -1.1880 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3510 -7.1450 -0.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0200 -6.2200 -0.3210 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9080 -8.5000 -0.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1600 -8.8500 -0.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4240 -10.1930 -0.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4240 -10.9180 -0.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0700 -9.9370 -1.3400 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.6650 2.0670 0.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6470 -0.3920 0.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4710 -1.6230 0.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5540 2.0650 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4360 3.2960 0.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7610 0.0070 0.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8920 -1.5320 0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3410 -1.5500 -1.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2100 -0.0110 -1.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8230 -0.0830 -2.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7070 -3.9020 -0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5920 -6.1880 -0.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5070 -4.7700 -1.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5380 -7.6690 -1.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8720 -8.1430 0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3690 -10.6300 -0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4660 -11.9840 -1.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 M END