COMGENEX-ZINC04875536 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 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 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4980 -1.2570 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -2.0270 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0930 0.0100 -1.2670 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7490 0.1540 -2.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2020 -0.1360 -3.4780 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1630 0.6750 -2.4460 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1860 1.6720 -2.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6730 0.7400 -3.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1290 1.2140 -3.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9690 0.2600 -3.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4410 0.2340 -1.6620 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0590 -0.2620 -1.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2540 -0.5170 -0.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5410 -0.3530 -0.6100 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1090 -1.1930 0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3630 -2.1140 0.7620 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8010 -1.8650 0.1400 S 0 0 0 0 0 0 0 0 0 0 0 0 10.5770 -1.0940 0.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7690 -0.1880 1.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7590 -0.7140 3.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9350 0.1170 4.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1210 1.4740 3.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1320 2.0000 2.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9610 1.1680 1.5500 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 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 -1.6240 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 -2.3880 -0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 -2.4050 -1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 -2.3790 -2.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5300 0.2420 -0.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6120 -0.2500 -4.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0630 1.4400 -4.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5110 1.2210 -4.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1840 2.2190 -3.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9240 -0.7420 -3.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0030 0.6030 -3.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7070 -0.2980 -0.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0240 -1.2620 -2.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9660 -2.0850 0.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1120 -0.6850 -0.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6130 -1.7740 3.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9260 -0.2940 5.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2580 2.1230 4.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2780 3.0600 2.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9730 1.5780 0.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 7 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 26 27 2 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 28 54 1 0 0 0 0 M END