IBS-ZINC00542830 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 41 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 3 0 0 0 0 0 0 0 0 0 -1.0200 -0.3820 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7440 -0.5120 1.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 -1.9790 1.1880 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5230 -2.4180 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7730 -1.8900 -1.2570 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3160 -2.1650 -2.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6730 -0.4660 -1.1730 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6300 -2.5000 -1.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4480 -2.4820 2.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6340 -3.8610 2.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2660 -4.3050 3.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3200 -5.7720 3.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8160 -6.7860 4.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7090 -8.1000 3.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1110 -8.4110 2.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6170 -7.4140 1.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7150 -6.0830 2.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3250 -4.9320 1.7210 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6650 -3.4170 4.5550 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4680 -2.1300 4.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8820 -1.6640 3.2760 N 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 1.7490 -0.0900 1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2040 -0.2100 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5410 -2.0260 -0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5510 -3.5070 -0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1730 -2.2240 -0.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1630 -2.1240 -2.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5530 -3.5850 -1.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2820 -6.5450 5.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0930 -8.8900 4.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0320 -9.4420 2.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1530 -7.6690 0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8020 -1.4310 5.1160 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 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 23 2 0 0 0 0 12 13 2 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 13 21 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 18 2 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 M END