IFLAB-ZINC04338649 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 47 0 0 1 0 0 0 0 0999 V2000 0.0020 1.4450 -0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -0.0200 -0.0460 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1420 -0.7060 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2000 -0.1110 -0.0300 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1270 -2.2010 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 -2.7960 -0.0290 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2870 -2.8870 -0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2710 -4.3520 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7080 -4.8770 0.0080 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.7020 -5.9620 -0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4600 -4.2860 -1.1090 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9150 -4.4950 -1.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5000 -4.1170 0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7270 -4.8600 1.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3420 -4.5090 1.2370 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6880 -3.4070 -2.2810 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.2870 -2.1180 -2.2760 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2960 -3.6170 -2.0890 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0930 -4.1380 -3.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2060 -3.7060 -4.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5250 -4.2780 -5.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7280 -5.2870 -6.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6120 -5.7180 -5.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2940 -5.1390 -4.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0400 -5.8510 -7.4640 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1750 -6.8840 -7.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0260 1.8190 -0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5220 1.7970 -0.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5090 1.8080 0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8630 -0.4960 -0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1320 -2.4110 -0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7600 -4.7150 -0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7470 -4.7040 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3520 -3.8630 -1.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1300 -5.5420 -1.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4050 -3.0420 0.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5510 -4.4020 0.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1240 -4.5860 2.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8340 -5.9350 1.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8260 -2.9220 -4.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3950 -3.9410 -6.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9900 -6.5030 -5.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4220 -5.4720 -3.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5370 -7.2470 -8.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1670 -6.4870 -8.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1610 -7.7050 -7.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 15 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 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 16 17 2 0 0 0 0 16 18 2 0 0 0 0 16 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 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 M END