OTAVA-ZINC05485958 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 0 0 0 0 0 0 0 0999 V2000 -0.0620 1.4620 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0310 -0.0450 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 -0.7340 1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 -2.1140 1.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -2.8130 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -2.1120 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 -0.7320 -1.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 -2.8600 -2.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -4.2950 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9390 -5.0390 0.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 -6.7480 0.2930 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9770 -6.4300 -0.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 -5.0600 -0.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3950 -4.6090 -1.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6240 -3.4180 -1.2790 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2880 -5.5260 -1.5810 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0270 -6.8510 -1.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9280 -7.2800 -0.8980 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5460 -5.0900 -2.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5950 -4.9290 -1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3180 -5.1560 0.0370 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8400 -4.5330 -1.4530 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7880 -4.2930 -0.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7910 -5.0640 0.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7280 -4.8250 1.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6640 -3.8200 1.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6680 -3.0480 0.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7350 -3.2850 -0.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7420 -2.5300 -1.7420 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7420 -1.5140 -1.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9580 1.8460 -0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5900 1.8160 -0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5760 1.8140 0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 -0.1920 2.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.6510 2.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0550 -0.1890 -2.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -3.0620 -2.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5020 -2.2570 -3.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5410 -3.8020 -2.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8470 -4.6400 0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7560 -7.5690 -1.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8760 -5.8360 -2.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3930 -4.1370 -2.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0790 -4.4140 -2.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0600 -5.8490 0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7280 -5.4250 2.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3940 -3.6380 2.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4000 -2.2640 0.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6230 -0.8080 -1.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7300 -1.9700 -1.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6350 -0.9880 -2.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 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 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 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 6 8 1 0 0 0 0 7 36 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 18 1 0 0 0 0 13 14 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 19 1 0 0 0 0 17 18 2 0 0 0 0 17 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 2 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 49 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 M END