OTAVA-ZINC05332913 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 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 -1.4120 -0.5260 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0700 -0.7580 -1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3660 -1.2360 -1.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0080 -1.4830 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3430 -1.2490 1.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0460 -0.7760 1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3180 -1.9660 0.0420 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9930 -2.2270 1.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3860 -2.7380 1.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7760 -2.8710 -0.0890 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.1980 -3.0460 2.0820 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.4790 -3.5160 1.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3780 -3.8560 2.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6460 -4.3190 2.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6710 -4.3160 0.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1460 -3.7400 0.2870 S 0 0 0 0 0 0 0 0 0 0 0 0 -12.7890 -4.7480 3.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.0630 -4.2300 2.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.1230 -4.6340 3.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.9240 -5.5490 4.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.6630 -6.0660 4.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5960 -5.6740 4.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0940 -3.7650 4.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3400 -2.7390 4.8500 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.5590 -4.8190 4.8950 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.3030 -4.6570 6.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7000 -5.9470 6.8750 C 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5710 -0.5650 -2.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8800 -1.4170 -2.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8390 -1.4400 2.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5270 -0.5980 2.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7810 -2.1300 -0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4330 -2.9740 1.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0480 -1.3040 1.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8860 -2.9400 2.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5160 -4.6220 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.2190 -3.5150 2.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.1100 -4.2330 3.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.7570 -5.8620 5.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5140 -6.7800 5.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6130 -6.0810 4.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6050 -3.8340 6.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2390 -4.4400 6.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5090 -5.8260 7.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3990 -6.7700 6.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7650 -6.1650 6.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 40 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 42 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 25 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 23 2 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 M END