IBS-ZINC02093119 MOE2007 3D CORINA 3.40 0006 02.08.2006 62 67 0 0 1 0 0 0 0 0999 V2000 0.4350 1.2990 1.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2450 0.5770 0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3220 0.1780 -0.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6180 0.4970 -0.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8080 1.2280 0.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7070 1.6260 1.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2590 1.4160 1.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8280 2.0010 1.9960 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8760 0.7500 -0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1580 0.6690 -0.3240 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6530 -0.3940 -1.0900 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9800 -0.4100 -1.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7100 0.6530 -1.7070 N 0 0 0 0 0 0 0 0 0 0 0 0 9.9600 0.2710 -2.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1360 0.9550 -2.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2170 0.2420 -2.7140 N 0 0 0 0 0 0 0 0 0 0 0 0 12.1970 -1.0780 -2.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1180 -1.7600 -2.3570 N 0 0 0 0 0 0 0 0 0 0 0 0 9.9900 -1.1340 -2.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7310 -1.5370 -1.6640 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2780 -2.9200 -1.4980 C 0 0 3 0 0 0 0 0 0 0 0 0 9.1280 -3.6020 -1.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2730 -3.2940 -2.6100 C 0 0 3 0 0 0 0 0 0 0 0 0 6.7930 -2.4000 -3.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2400 -4.1930 -1.8960 C 0 0 3 0 0 0 0 0 0 0 0 0 5.2480 -3.7440 -1.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7410 -4.2560 -0.4370 C 0 0 3 0 0 0 0 0 0 0 0 0 7.3550 -5.1440 -0.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5370 -3.0620 -0.2660 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5580 -4.2550 0.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0360 -4.4410 1.8670 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2230 -5.4980 -2.4800 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9300 -4.0140 -3.6560 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1680 2.3390 -2.4520 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8450 0.2200 -0.8370 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0330 -0.5260 -2.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3820 0.4300 -3.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6610 0.9470 -3.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9820 1.8240 -4.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0230 2.1850 -5.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7440 1.6670 -5.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4250 0.7850 -4.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4250 3.2870 -6.5120 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 1.6100 1.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7560 0.3250 -0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 -0.3840 -1.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8530 2.1890 2.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0640 -1.1190 -1.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0980 -1.6180 -2.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0340 -3.3020 0.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8760 -5.0650 0.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3390 -4.4510 2.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5910 -6.1040 -2.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3450 -4.2740 -4.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3720 2.8480 -2.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9850 2.7990 -2.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8410 -1.2470 -1.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1130 -1.0540 -2.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4100 0.6660 -2.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9810 2.2290 -4.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9940 1.9480 -5.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4280 0.3770 -4.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 44 1 0 0 0 0 2 3 2 0 0 0 0 2 45 1 0 0 0 0 3 4 1 0 0 0 0 3 46 1 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 47 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 48 1 0 0 0 0 12 13 2 0 0 0 0 12 20 1 0 0 0 0 13 14 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 34 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 49 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 29 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 33 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 32 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 30 1 0 0 0 0 30 31 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 31 52 1 0 0 0 0 32 53 1 0 0 0 0 33 54 1 0 0 0 0 34 55 1 0 0 0 0 34 56 1 0 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 36 57 1 0 0 0 0 36 58 1 0 0 0 0 37 38 1 0 0 0 0 37 42 2 0 0 0 0 38 39 2 0 0 0 0 38 59 1 0 0 0 0 39 40 1 0 0 0 0 39 60 1 0 0 0 0 40 41 2 0 0 0 0 40 43 1 0 0 0 0 41 42 1 0 0 0 0 41 61 1 0 0 0 0 42 62 1 0 0 0 0 M END