IBS-ZINC05577197 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 0.2200 1.1620 0.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 0.0690 -0.4010 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2190 -0.5790 -0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1190 -0.1670 0.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3230 -0.8200 0.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6410 -1.8980 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7340 -2.3120 -0.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5300 -1.6460 -1.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0380 -3.3600 -1.7440 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9340 -2.6010 0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1310 -1.8780 0.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3160 -2.5830 0.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2800 -3.9070 0.5020 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1330 -4.5620 0.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9800 -3.9310 0.2510 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1430 -5.9480 0.4470 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1300 -0.5180 0.2680 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3060 0.1280 0.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0720 0.5590 -0.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2670 1.2150 -0.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7030 1.4440 0.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9440 1.0170 2.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7470 0.3530 1.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0020 -0.0720 2.8430 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5170 0.1940 4.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1970 1.5900 0.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5490 1.9240 0.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2040 0.8080 1.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8740 0.6670 1.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0200 -0.4970 1.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8300 -1.9600 -1.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4990 -3.1110 -2.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2560 -2.0600 0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9810 -6.4240 0.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3110 -6.4410 0.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7340 0.3820 -1.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8630 1.5510 -1.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6370 1.9580 1.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2860 1.1960 3.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6280 1.2690 4.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4880 -0.2890 4.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8280 -0.1970 4.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 M END