ASINEX-ZINC02836479 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 1 0 0 0 0 0999 V2000 -0.5030 1.5440 0.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5630 0.0180 0.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6740 -0.4780 1.1720 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7870 -1.8250 1.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9610 -2.3730 1.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0770 -3.7410 1.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0180 -4.5690 1.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1560 -4.0200 1.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2720 -2.6510 0.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1360 -5.9570 1.7540 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5180 -6.7810 0.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 -6.3240 -0.0790 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5450 -8.2710 1.1100 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5020 -8.5550 1.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5880 -8.6640 2.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3280 -9.1240 -0.4720 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5470 -10.7940 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4870 -11.8210 -0.7290 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 -13.0380 -0.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6610 -14.3010 -0.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8770 -15.4430 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1150 -15.3740 1.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1350 -14.1510 1.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9170 -12.9820 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8860 -11.2940 1.6990 S 0 0 0 0 0 0 0 0 0 0 0 0 0.3120 1.8380 -0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4460 1.9220 0.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3330 1.9590 1.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3780 -0.2760 1.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7330 -0.3980 -0.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7840 -1.7290 2.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9910 -4.1680 2.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9800 -4.6630 0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1870 -2.2230 0.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6620 -6.3250 2.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5690 -9.7410 2.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4580 -8.1500 3.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5450 -8.3790 1.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4770 -14.3700 -1.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8620 -16.4040 -0.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2840 -16.2780 1.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3190 -14.0990 2.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 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 13 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 25 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 M END