IBS-ZINC04088974 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 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 0.7420 -0.5110 1.2420 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2850 -0.0870 2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2100 -0.0860 1.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6550 -2.0370 1.2990 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3900 -2.3440 1.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 -2.6270 0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3290 -3.3690 0.3100 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2600 -2.5140 2.5450 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8820 -3.6980 3.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -4.3700 2.5030 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4910 -4.1790 4.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4620 -3.4040 4.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0340 -3.8340 6.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6580 -5.0560 6.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6830 -5.8440 6.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0960 -5.3990 4.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5210 -7.0420 6.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3610 -6.9160 7.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0470 -5.7350 7.8180 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -5.4250 8.4540 H 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 -1.0200 -0.3810 0.0100 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 2.6670 -0.5090 0.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2720 1.0020 1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7370 -0.4470 2.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9310 -1.9780 2.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7600 -2.4560 4.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7800 -3.2270 6.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3450 -5.9970 4.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 -7.8690 6.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4780 -7.6380 8.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0130 -2.3270 -1.1270 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5170 -2.7290 -1.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 8 9 2 0 0 0 0 8 37 1 0 0 0 0 10 11 1 0 0 0 0 10 31 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 18 2 0 0 0 0 14 15 2 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 34 1 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 37 38 1 0 0 0 0 M END