ASINEX-ZINC00826760 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 61 0 0 0 0 0 0 0 0999 V2000 0.2540 1.1060 -0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1070 -0.3790 -0.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3500 -1.2520 0.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2180 -2.6120 0.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1630 -3.1070 -0.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4070 -2.2200 -1.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2760 -0.8620 -1.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5910 0.2590 -2.9300 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.8840 -0.5380 -4.0700 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4800 1.2420 -2.4190 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8310 1.0400 -3.2590 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8540 0.4230 -4.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2600 1.4370 -5.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6190 2.6700 -4.5650 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5520 3.2930 -3.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1070 2.3760 -2.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3070 -4.5620 -0.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6380 -4.9900 -2.0560 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 -5.4150 0.0470 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3190 -6.7310 -0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5810 -7.4910 -0.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3300 -8.8290 -1.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8180 -9.4160 -0.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7220 -8.6610 0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4690 -7.3180 0.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8840 -9.2550 0.5860 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0130 -8.5290 0.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0440 -7.3820 0.3090 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2120 -9.1280 1.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3830 -8.3780 1.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4990 -8.9430 2.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4600 -10.2500 2.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3020 -10.9990 2.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1810 -10.4470 1.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9950 -11.0160 3.2920 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.2450 1.4230 -0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5050 1.6330 -0.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1280 1.3360 0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6450 -0.8670 1.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4080 -3.2920 1.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7020 -2.5970 -2.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7240 0.1550 -3.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4460 -0.4700 -4.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1120 1.0520 -5.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4230 1.6040 -5.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8940 4.2440 -3.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7120 3.4670 -4.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2040 2.7760 -2.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9000 2.3090 -1.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4790 -7.0340 -1.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0320 -9.4180 -1.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0110 -10.4630 -0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1680 -6.7300 0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8780 -10.1900 0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4150 -7.3580 1.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4060 -8.3640 2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2780 -12.0180 2.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2800 -11.0330 1.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 5 6 2 0 0 0 0 5 17 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 50 1 0 0 0 0 22 23 1 0 0 0 0 22 51 1 0 0 0 0 23 24 2 0 0 0 0 23 52 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 53 1 0 0 0 0 26 27 1 0 0 0 0 26 54 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 55 1 0 0 0 0 31 32 1 0 0 0 0 31 56 1 0 0 0 0 32 33 2 0 0 0 0 32 35 1 0 0 0 0 33 34 1 0 0 0 0 33 57 1 0 0 0 0 34 58 1 0 0 0 0 M END