OTAVA-ZINC01984733 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 1 0 0 0 0 0999 V2000 -0.0230 1.5320 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 0.0020 -0.0010 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5280 -0.3520 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7080 -0.4920 -1.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0980 -1.1230 -2.0730 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0180 -0.2310 -1.4130 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6980 -0.7700 -2.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0460 -0.9180 -3.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7190 -1.4510 -4.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0420 -1.8360 -4.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6940 -1.6900 -3.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0270 -1.1530 -2.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8850 -2.5050 -6.0450 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.3610 -0.5030 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9210 -0.7130 1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2950 -0.4820 2.2210 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3310 -1.2370 1.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7250 -1.3850 2.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1570 -1.9160 2.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5340 -2.0580 4.2790 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1160 -1.0920 5.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4060 0.0190 4.6180 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3410 -1.6090 6.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8910 -1.0800 7.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9550 -1.8550 8.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4740 -3.1510 8.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9220 -3.6940 7.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8510 -2.9310 6.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3490 -3.1740 5.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8500 -4.2070 4.6090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9980 1.9110 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5510 1.8850 -0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5350 1.8890 0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4910 0.3300 -0.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0140 -0.6180 -3.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2120 -1.5660 -5.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7260 -1.9920 -3.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5380 -1.0350 -1.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0110 -0.5390 0.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3910 -2.2080 0.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0460 -2.0830 3.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6650 -0.4140 3.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8360 -1.2190 2.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2170 -2.8870 2.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2680 -0.0680 7.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3820 -1.4430 9.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5290 -3.7440 9.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5470 -4.7070 7.5360 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 4 1 0 0 0 0 2 14 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 12 38 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 29 1 0 0 0 0 21 22 2 0 0 0 0 21 23 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 2 0 0 0 0 M END