IBS-ZINC04305116 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 38 0 0 1 0 0 0 0 0999 V2000 -0.0360 1.5260 -0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.0010 0.0050 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8160 -0.4030 1.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0910 -1.9230 1.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5260 -2.1060 -0.6500 S 0 0 0 0 0 0 0 0 0 0 0 0 2.9290 -1.9470 -0.8100 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8790 -3.2550 -1.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6740 -0.6000 -1.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3650 -0.5170 0.1220 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2640 -0.2750 -0.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7770 0.5210 -2.2870 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.5460 -0.6590 -0.6970 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5240 -0.3950 -1.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8720 -0.9200 -1.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7470 -0.1030 -0.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9850 -0.5850 -0.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3480 -1.8820 -0.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4730 -2.6990 -1.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2370 -2.2160 -1.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9810 1.9170 -0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5040 1.8060 -1.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6120 1.9400 0.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7570 0.1470 1.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 -0.2000 2.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9260 -2.2190 1.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1980 -2.5000 1.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0770 -0.8600 -1.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3950 0.1030 -1.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6220 -1.0350 0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8220 -1.1100 0.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5900 0.6790 -1.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2090 -0.8930 -2.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4640 0.9110 -0.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6680 0.0530 0.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3140 -2.2590 -0.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7560 -3.7130 -1.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5560 -2.8530 -2.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 9 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 4 26 1 0 0 0 0 5 6 2 0 0 0 0 5 7 2 0 0 0 0 5 8 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 13 32 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 33 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 2 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 M END