IBS-ZINC06759354 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 -0.1280 2.4800 -1.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 1.0920 -0.9680 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4030 0.2140 -1.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 0.6740 -2.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8450 -0.2160 -3.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7720 -1.5680 -3.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0060 -2.0360 -2.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3260 -1.1530 -1.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4190 -1.6180 -0.4780 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4500 -3.0340 -0.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5130 -2.5840 -4.2280 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3410 -2.9920 -3.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0340 -1.9440 -5.4410 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6820 -0.6320 -5.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6290 0.3600 -4.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9230 -2.5350 -6.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3080 -3.5780 -6.7590 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4940 -1.9690 -7.7290 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2800 -2.5490 -9.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0320 -1.7220 -10.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8120 -2.3180 -11.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1240 -3.3040 -11.5940 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3800 -1.7550 -12.5460 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1250 -2.3830 -13.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5740 -3.6980 -4.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8520 -4.9980 -4.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9910 -6.0200 -4.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1500 -5.7410 -5.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4280 -4.4400 -5.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4310 -3.4180 -5.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9220 2.7680 -1.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 2.6620 -2.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7060 3.0700 -0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2270 1.7350 -3.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9440 -3.0980 -2.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0780 -3.2700 0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8580 -3.5130 -1.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5610 -3.3990 -0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4900 -0.7020 -4.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0800 -0.3030 -6.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9460 0.5910 -5.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1220 1.2760 -4.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0460 -1.1780 -7.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6500 -3.5740 -9.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2140 -2.5440 -9.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6620 -0.6970 -10.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0970 -1.7270 -9.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4880 -3.4100 -13.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0530 -2.3800 -14.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6410 -1.8300 -14.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7430 -5.2160 -3.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -7.0360 -4.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 -6.5390 -5.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3190 -4.2220 -6.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2110 -2.4010 -5.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 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 34 1 0 0 0 0 5 6 1 0 0 0 0 5 15 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 25 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 28 29 2 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 30 55 1 0 0 0 0 M END