OTAVA-ZINC05548511 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 34 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 0.7630 -2.0410 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4920 -2.5400 2.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9610 -2.8120 3.6130 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8660 -3.2160 4.4310 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0370 -3.2250 3.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8340 -2.7980 2.5500 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7980 -2.6540 1.5440 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4260 -1.5270 1.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4410 -1.3760 0.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1300 -0.1680 0.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0710 -0.0700 -0.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3240 -1.0940 -1.6230 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6990 -2.2480 -1.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7470 -2.4370 -0.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5740 -3.7020 4.5520 S 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 -0.2600 -2.4180 1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -2.3920 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2050 -0.7010 2.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9270 0.6740 0.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6080 0.8570 -0.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9390 -3.0590 -2.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2430 -3.3870 -0.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5700 -5.0790 4.2450 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 24 1 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 18 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 17 32 1 0 0 0 0 18 33 1 0 0 0 0 M END