OTAVA-ZINC04514053 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 1 0 0 0 0 0999 V2000 -1.5850 0.6850 0.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1220 -0.7340 0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5680 -1.4420 1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1410 -2.7390 1.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2660 -3.3460 -0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8280 -2.6260 -1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2580 -1.3210 -1.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 -3.2180 -2.4820 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6910 -2.4370 -3.6930 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6190 -2.0450 -4.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 -3.2740 -4.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4220 -4.2810 -5.2070 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2390 -2.8050 -5.0320 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7160 -1.6920 -4.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7980 -1.1830 -4.6920 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4820 -1.0840 -3.3440 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0220 -3.4910 -5.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0090 -3.1020 -7.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7810 -3.7790 -8.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5670 -4.8440 -7.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5820 -5.2330 -6.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8160 -4.5560 -5.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1890 -4.7330 -0.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1830 -5.2200 -1.4800 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7630 1.3700 0.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4160 0.9000 -0.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9100 0.8110 1.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4700 -0.9740 2.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2900 -3.2860 1.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6950 -0.7640 -1.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2250 -4.1470 -2.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3950 -2.2710 -7.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7710 -3.4780 -9.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1700 -5.3720 -8.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1960 -6.0650 -6.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8320 -4.8580 -4.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6120 -5.4620 0.6860 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9010 -6.3670 0.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 16 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 20 21 2 0 0 0 0 20 34 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 22 36 1 0 0 0 0 23 24 2 0 0 0 0 23 37 1 0 0 0 0 37 38 1 0 0 0 0 M END