ASINEX-ZINC04906295 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 37 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -0.4900 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 -0.8070 -2.3240 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0090 -0.7170 -2.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5410 -1.2480 -3.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1200 -1.5360 -4.4430 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0070 -1.3660 -3.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7070 -1.8090 -4.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0810 -1.8990 -4.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7700 -1.5540 -3.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0970 -1.1140 -2.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7050 -1.0130 -2.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0030 -0.5790 -1.2150 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6960 -0.6310 0.0150 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.2220 -0.0570 1.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4900 -0.3240 2.0170 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0930 -0.8260 1.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9160 0.1130 3.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0530 0.8180 4.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7500 1.0730 3.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.7020 4.2460 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3810 0.6180 2.3510 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1940 -0.1540 3.6740 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1760 -2.0790 -5.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6260 -2.2420 -5.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8470 -1.6310 -3.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6440 -0.8480 -1.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3630 1.1750 5.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8020 -0.6550 3.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4890 0.1590 4.5440 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 4 1 0 0 0 0 2 16 1 0 0 0 0 4 5 1 0 0 0 0 4 15 2 0 0 0 0 5 6 1 0 0 0 0 5 7 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 2 0 0 0 0 10 11 2 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 12 13 2 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 24 2 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 21 33 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 25 34 1 0 0 0 0 25 35 1 0 0 0 0 M END