IBS-ZINC02338297 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 54 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3830 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1970 -0.6900 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 0.0100 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 1.4140 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 2.0940 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7900 1.8420 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5440 0.6880 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7200 -0.3900 -0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0180 -1.3130 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2900 3.2150 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6320 3.4520 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2490 4.7310 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6980 5.8190 -0.0240 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6970 4.4610 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8270 5.2790 -0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0730 4.7180 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2180 3.3330 -0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1050 2.5080 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8320 3.0630 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6020 2.5070 -0.0410 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2760 1.0110 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2710 -0.9480 1.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1980 -1.4160 2.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4390 -0.9270 3.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5170 0.5990 3.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5520 1.0090 1.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4610 2.7870 -0.0900 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9080 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -0.5520 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -1.7700 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 3.1740 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6230 0.6480 -0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5960 4.0420 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7170 6.3530 -0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9480 5.3510 -0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4280 0.5520 -0.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1970 0.7530 -0.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1590 -1.3680 0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3820 -1.2820 0.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3030 -1.0080 3.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1600 -2.5060 2.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3700 -1.2220 4.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3310 -1.3670 3.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6420 1.0400 3.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4210 0.9500 3.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5930 2.0960 1.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4330 0.5800 1.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8290 2.6250 0.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3440 0.5180 1.3040 N 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 11 12 2 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 21 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 20 2 0 0 0 0 16 17 2 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 19 2 0 0 0 0 18 28 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 22 50 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 27 50 1 0 0 0 0 28 49 1 0 0 0 0 M END