CHEMDIV-ZINC04885718 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 1 0 0 0 0 0999 V2000 0.9800 1.1780 0.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8170 -0.3160 0.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6830 -0.9650 1.3680 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3390 -0.8400 0.2260 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3890 -0.0710 -0.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4890 -1.0570 -0.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9390 -2.3630 -0.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7070 -2.1970 0.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -3.2840 0.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6030 -4.5510 0.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8530 -4.7310 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5250 -3.6160 -0.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4780 -6.1010 -0.0890 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.2760 -6.1120 -0.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0290 -6.5870 1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2310 -8.7370 0.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0350 -10.2540 0.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5800 -10.8700 1.7210 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4330 -10.2480 2.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6440 -8.7380 2.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1620 -12.0320 2.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3170 -12.2690 3.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9030 -13.4450 4.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3430 -14.4060 3.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2100 -14.2110 1.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6250 -13.0320 1.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9020 -15.5340 3.6190 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.5150 -7.0910 -0.5180 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9270 1.4880 1.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9990 1.4560 -0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1670 1.7000 1.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7760 0.7030 0.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9480 0.4240 -1.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4350 -0.8220 -0.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6320 -1.0570 -1.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9340 -3.1780 1.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 -5.4050 1.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4900 -3.7150 -1.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3810 -6.2740 2.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0500 -6.2480 1.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4140 -8.2620 -0.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0620 -8.5180 1.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9900 -10.6670 0.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2910 -10.4490 -0.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2110 -10.6920 3.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5430 -10.4190 1.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4690 -8.5190 3.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7240 -8.2660 2.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0110 -11.5230 4.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0190 -13.6080 5.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5510 -14.9750 1.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5070 -12.9200 0.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 -6.6640 -1.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9910 -8.1070 1.2380 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.2010 -8.2840 0.5760 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 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 28 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 15 54 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 16 54 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 20 54 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 26 52 1 0 0 0 0 28 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END