IBS-ZINC02129942 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 0 0 0 0 0 0999 V2000 0.2390 1.4370 -0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 -0.0040 -0.0490 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -0.7890 1.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1130 -0.4550 2.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -1.4880 3.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0920 -2.8190 3.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1420 -3.1410 1.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0650 -2.1220 0.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 -2.0930 -0.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -0.8020 -1.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 -0.4510 -2.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1770 0.6930 -2.9820 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0770 -1.5730 -3.3790 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1830 -2.8520 -2.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1900 -3.1820 -1.5950 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0830 -1.3770 -4.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3400 -1.2630 -5.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3360 -0.8470 -6.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2290 0.3940 -7.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1220 1.3960 -6.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2710 0.2090 -8.7310 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2090 0.9480 -9.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4140 -1.0870 -9.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4840 -1.5290 -10.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4520 -1.7360 -7.8490 N 0 3 0 0 0 0 0 0 0 0 0 0 1.5640 -2.7440 -7.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1770 -3.9000 3.8480 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1300 -3.6380 5.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 1.6890 -0.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6220 1.8450 -0.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2620 1.8460 0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2110 0.5740 2.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 -1.2080 4.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2410 -4.1770 1.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2650 -3.6450 -3.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6030 -2.2150 -5.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6550 -0.4680 -5.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9230 -0.5300 -4.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8610 -2.2230 -5.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8230 -3.1810 5.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9770 -3.0190 5.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2080 -4.5960 5.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 10 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 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 15 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 25 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 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 2 0 0 0 0 25 26 1 0 0 0 0 27 28 1 0 0 0 0 28 40 1 0 0 0 0 28 41 1 0 0 0 0 28 42 1 0 0 0 0 M CHG 1 25 1 M END