IFLAB-ZINC05154776 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 -2.0180 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8390 -2.6820 0.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8360 -4.0880 0.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7810 -4.7120 0.2710 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7660 -4.7330 1.2340 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -5.7030 1.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2800 -4.0180 1.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2660 -2.6980 1.7320 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6720 -4.8680 2.4000 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.6970 -3.4590 2.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9800 -3.9600 3.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0540 -4.1860 4.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2320 -4.6490 5.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3400 -4.8890 4.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3020 -4.6670 3.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1060 -4.1900 2.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0690 -3.9620 1.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1800 -4.1960 0.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3570 -4.6590 1.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4260 -4.9020 2.4790 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 -1.0200 -0.3810 0.0100 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 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6790 -2.1360 0.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1580 -2.8530 3.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9260 -2.8550 2.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1880 -4.0040 5.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2640 -4.8200 6.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2460 -5.2480 5.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1640 -3.6030 0.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1490 -4.0200 -0.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2240 -4.8370 0.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3450 -5.2620 2.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 11 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 40 1 0 0 0 0 M END