IBS-ZINC04904980 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 1 0 0 0 0 0999 V2000 -0.3510 -0.8930 0.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 0.2600 0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0910 1.7070 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3300 2.0620 -0.0080 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1390 2.0650 -1.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8680 1.7630 -2.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8680 1.8460 -3.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1490 2.2300 -3.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4370 2.5330 -1.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4360 2.4520 -0.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4090 2.7030 0.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4040 3.0870 1.4420 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6330 3.4340 0.8680 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6910 3.7090 1.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5790 3.6570 2.8620 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0140 4.0820 1.0380 C 0 0 3 0 0 0 0 0 0 0 0 0 8.3240 3.3080 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8830 5.4240 0.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1580 5.7540 -0.2590 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2400 5.6100 0.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4310 6.2360 0.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5400 6.0960 1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4650 5.3330 2.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2800 4.7080 2.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1640 4.8450 1.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0030 4.2270 2.0640 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0150 2.4330 1.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5680 2.5260 2.2140 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4540 -1.9250 0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.9640 -0.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6050 2.2550 0.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8720 1.4620 -2.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6500 1.6100 -4.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9240 2.2910 -3.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4360 2.8320 -1.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7240 3.4750 -0.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1420 5.3360 -0.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5790 6.1990 1.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4930 6.8320 -0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4660 6.5840 0.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3330 5.2250 2.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2240 4.1120 3.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 3 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 27 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 26 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 27 28 2 0 0 0 0 M END