IBS-ZINC05452123 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 0.8680 1.6210 0.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0600 1.0690 -0.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1000 0.1590 -0.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9680 -0.2150 0.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7550 0.3560 1.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7150 1.2660 1.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0630 -1.1760 0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3830 -0.8750 0.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4230 -1.7860 0.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1660 -3.0190 -0.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8570 -3.3430 -0.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8200 -2.4260 -0.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3040 -3.9470 -0.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2740 -3.9060 0.2440 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2180 -4.8230 -1.5770 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2660 -5.7760 -1.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3390 -6.9830 -0.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4340 -6.8970 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7040 -5.7600 0.7610 N 0 3 0 0 0 0 0 0 0 0 0 0 9.1690 -4.8710 0.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7340 -5.9480 1.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1540 -5.2240 2.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1460 -7.2050 1.3940 N 0 0 0 0 0 0 0 0 0 0 0 0 11.9210 -7.6360 1.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3660 -7.8170 0.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5810 -8.8390 0.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 2.3280 0.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4030 1.3460 -1.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2340 -0.2490 -1.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3950 0.0870 2.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5680 1.6930 2.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6180 0.0830 0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4340 -1.5170 0.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6050 -4.3080 -1.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8060 -2.7040 -0.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4050 -4.7970 -2.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0170 -6.1260 -2.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2190 -5.2380 -1.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3930 -7.1370 -0.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5260 -7.8820 -1.5800 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 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 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 25 2 0 0 0 0 19 20 1 0 0 0 0 19 21 2 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 M CHG 1 19 1 M END