IBS-ZINC05451947 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 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 -1.4120 -0.5260 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0720 -0.7580 -1.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3680 -1.2370 -1.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0050 -1.4830 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3450 -1.2510 1.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0470 -0.7770 1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4200 -2.0040 0.0430 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.7710 -2.1230 -0.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4600 -3.3560 0.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2720 -3.1570 2.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6650 -3.9870 2.8800 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7690 -2.0710 2.8550 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4470 -1.1000 2.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3070 -1.0290 0.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0050 -0.0370 0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9060 0.0570 -1.1470 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7890 0.8130 0.7640 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.2810 1.5080 0.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8900 0.6980 2.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2440 -0.2220 2.7670 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.7730 1.6600 2.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5740 -0.5660 -2.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8840 -1.4180 -2.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8430 -1.4430 2.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5300 -0.5990 2.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4220 -3.8340 0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6620 -3.9920 0.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6510 -1.9670 3.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7810 1.2520 2.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3750 1.8100 3.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8010 2.6140 2.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 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 9 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 16 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 22 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 M END