COMGENEX-ZINC04734986 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 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 -1.3600 -0.5070 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 -1.8400 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 -2.5620 -0.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9020 -2.4340 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8060 -3.8960 0.0080 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9260 -4.6460 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0170 -4.1080 0.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8370 -5.9900 0.0060 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5560 -6.6930 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7120 -8.0420 -0.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3600 -8.5670 -0.1270 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.0230 -6.8610 0.0190 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.6690 -6.6330 -0.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7780 -6.6980 1.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1000 -6.3670 2.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7910 -6.2170 3.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1600 -6.3980 3.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8420 -6.7300 2.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1480 -6.8750 1.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1890 -6.9090 2.5610 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.8390 -6.7400 3.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3180 -6.9760 3.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8370 -8.2470 3.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.1940 -8.4640 3.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.0330 -7.4100 3.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5140 -6.1390 3.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1570 -5.9210 3.3550 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 0.5120 -0.3560 -0.8950 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 -3.4310 -2.1110 0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4480 -2.1010 -0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9360 -4.3250 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8110 -6.0780 -0.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2340 -6.8840 1.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7330 -7.8940 -1.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9330 -8.7490 -0.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0300 -6.2250 2.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2590 -5.9590 4.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6990 -6.2820 4.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6780 -7.1290 0.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4320 -7.4540 4.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6700 -5.7260 4.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1820 -9.0700 4.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6000 -9.4570 3.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.0930 -7.5790 3.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.1690 -5.3160 2.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7530 -4.9280 3.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 37 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 14 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 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 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 27 28 2 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 29 52 1 0 0 0 0 M END