OTAVA-ZINC05550628 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -0.3520 0.9900 2.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2470 -0.4040 1.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5030 -0.7630 1.1880 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5810 -1.9820 0.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4730 -2.8130 0.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5540 -4.0520 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7390 -4.4650 -0.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8490 -3.6420 -0.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7770 -2.4000 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9020 -1.5660 0.0420 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1380 -2.0970 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2810 -3.3020 -0.0500 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3420 -1.1950 -0.1360 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.2610 -0.5700 -1.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4080 -0.3070 1.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5570 -2.0090 -0.2200 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.8640 -2.8700 0.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9310 -3.6110 0.7500 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.7940 -3.5640 -0.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5430 -2.7080 -1.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3660 -1.8960 -1.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0990 -1.1210 -2.1940 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.5630 -2.7770 -2.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5420 -3.6450 -2.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2860 -4.4440 -0.5810 S 0 0 0 0 0 0 0 0 0 0 0 0 -12.7260 -3.9080 -3.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4000 -3.3650 -4.4320 C 0 0 3 0 0 0 0 0 0 0 0 0 -11.6270 -3.9800 -4.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8980 -1.9240 -4.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5100 -1.9350 -3.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.6600 -3.3930 -5.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6070 1.2640 2.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6160 1.7130 1.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1200 0.9870 3.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5210 -0.4000 0.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -1.1270 2.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 -2.4930 1.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3110 -4.6980 -0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7980 -5.4340 -1.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7740 -3.9680 -1.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7920 -0.6060 0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4890 -0.9320 1.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5040 0.2990 1.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2790 0.3460 1.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2030 -2.9410 1.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9110 -4.9800 -3.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6090 -3.4030 -2.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8370 -1.4670 -5.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5850 -1.3540 -3.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2170 -0.9150 -3.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7880 -2.3640 -4.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.4310 -2.7740 -4.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.4270 -3.0060 -6.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0200 -4.4180 -5.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 41 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 15 1 0 0 0 0 13 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 17 18 2 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 25 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 2 0 0 0 0 23 24 2 0 0 0 0 23 30 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 31 1 0 0 0 0 29 30 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 M END