COMGENEX-ZINC04239743 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 0 0 0 0 0 0999 V2000 0.1610 1.5170 -0.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1410 -0.0090 -0.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1030 -0.4510 0.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2760 -0.4760 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1700 -0.1840 -1.1480 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2620 -1.1170 -2.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4200 -2.0560 -2.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1020 -1.9540 -1.0560 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6990 -3.0070 -2.9660 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9800 -3.2680 -4.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6780 -4.4290 -4.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3620 -4.9270 -5.9440 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7030 -4.8250 -4.1120 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7790 -4.0000 -2.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5720 -5.8790 -4.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4040 -6.6030 -5.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2620 -7.6440 -5.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2890 -7.9650 -5.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4580 -7.2450 -3.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5990 -6.2080 -3.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3660 -9.2730 -5.3920 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.9070 0.9440 -1.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7560 1.7690 -0.2640 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8900 1.1790 -2.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6020 2.3310 -2.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4570 2.2790 -3.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4470 1.1250 -4.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3370 0.0250 -3.4570 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1870 1.8580 -0.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4420 1.8260 -1.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2490 1.9540 0.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 -0.4470 -1.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7930 -0.0130 1.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 -1.5380 0.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1120 -0.1180 0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2690 -1.5500 0.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6280 0.0460 0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4160 -0.5590 -3.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3380 -1.6920 -2.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0240 -2.3890 -4.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9420 -3.5260 -4.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6560 -4.6250 -2.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7430 -3.4940 -2.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6030 -6.3520 -6.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1320 -8.2060 -6.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2610 -7.4980 -3.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7290 -5.6490 -2.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5040 3.1960 -1.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0910 3.1080 -3.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0570 0.9200 -5.0090 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 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 22 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 10 41 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 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 47 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 2 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 M END