ASINEX-ZINC06681582 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 33 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 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4980 -1.2570 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2440 -0.0640 -2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6300 -2.0230 -1.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1250 -0.0910 -1.2090 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9140 0.3240 -2.6050 S 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 0.6970 -2.2240 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6390 -0.7060 -3.5440 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1440 1.7820 -3.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5610 3.0440 -2.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8330 4.0380 -3.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5970 3.3160 -4.4850 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1140 1.7420 -4.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0480 5.4760 -3.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9370 5.8670 -2.5420 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2620 6.3640 -3.9160 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4760 7.8010 -3.7280 C 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 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1040 -2.4560 -0.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4160 -2.3260 -1.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1400 -2.3750 -2.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5940 -0.0650 -0.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3820 3.2310 -2.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6680 0.8340 -4.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5530 6.0520 -4.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3540 8.0520 -2.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4850 8.0630 -4.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7500 8.3580 -4.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 24 1 0 0 0 0 5 25 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 14 2 0 0 0 0 11 12 2 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 14 29 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 30 1 0 0 0 0 18 31 1 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 M END