OTAVA-ZINC02887713 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 0.0300 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4140 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0870 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6710 2.1860 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1530 2.3450 -1.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8510 3.3520 -2.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3990 3.2650 -3.4600 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1490 2.2330 -3.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2190 1.2380 -2.3000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.8040 1.9760 -4.8870 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6830 2.8340 -5.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0020 3.8310 -5.8030 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3940 2.5550 -7.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1050 3.6280 -8.1740 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6580 3.5880 -9.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3840 4.6050 -10.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9320 4.5640 -11.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7520 3.5110 -11.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0260 2.4960 -11.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4850 2.5360 -9.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2860 3.4720 -13.2390 F 0 0 0 0 0 0 0 0 0 0 0 0 3.5770 -0.6290 -0.0350 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 -1.7590 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1540 3.1670 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5100 3.1700 0.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4200 1.6470 0.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2100 4.1710 -1.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3490 1.1790 -4.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4690 2.5060 -7.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0490 1.6040 -7.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5310 4.3650 -7.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7440 5.4260 -10.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7190 5.3540 -12.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6650 1.6760 -11.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7020 1.7460 -9.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 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 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 24 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