ASINEX-ZINC04937842 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 50 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 -1.3390 -0.4990 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 -1.8480 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3870 -2.6800 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5520 -4.0510 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8240 -4.5960 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9320 -3.7690 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7720 -2.3970 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9810 -1.4970 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0310 -6.3450 -0.0140 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.3240 -6.5940 -0.5480 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8420 -6.8880 -0.5720 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0740 -6.8410 1.5660 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1730 -6.4180 2.4370 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0480 -6.1860 1.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7520 -5.1730 3.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5070 -7.5280 3.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8890 -8.5700 3.3610 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4940 -7.3620 4.3020 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8190 -8.4420 5.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9500 -8.0060 6.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2690 -8.2400 5.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2800 -7.8260 6.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0010 -7.2160 7.7590 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7580 -6.9780 8.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6960 -7.3680 7.3380 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 0.5120 -0.3560 -0.8950 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 0.6050 -2.2550 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3120 -4.6980 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9240 -4.1970 0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2870 -1.2740 -0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7960 -1.9970 0.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7330 -0.5700 0.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3710 -7.4120 1.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5700 -4.8580 3.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8760 -5.4040 3.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5100 -4.3700 2.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9890 -6.5290 4.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1190 -9.3280 4.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9440 -8.6730 5.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5040 -8.7380 4.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3100 -8.0040 6.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5690 -6.4760 9.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6800 -7.1730 7.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 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 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 49 1 0 0 0 0 M END