OTAVA-ZINC05486096 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 0 0 1 0 0 0 0 0999 V2000 -0.0470 1.4660 0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 -0.0410 0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 -0.7450 1.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -2.1250 1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.8090 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 -2.0940 -1.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -0.7140 -1.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -4.2910 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 -5.0090 0.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -6.7270 0.4610 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.6740 -6.4490 -0.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8950 -5.0840 -0.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9560 -4.6650 -1.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1910 -3.4800 -1.8060 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6910 -5.6040 -2.2700 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4240 -6.9220 -2.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4560 -7.3220 -1.3140 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7850 -5.2000 -3.1570 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8500 -4.1120 -3.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1030 -5.7770 -2.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5230 -5.7200 -4.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5200 -6.3650 -4.7740 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4020 -5.4700 -5.5370 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1140 -5.8720 -6.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4130 -7.0480 -7.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1310 -7.4430 -8.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5440 -6.6700 -9.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2420 -5.4970 -9.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5350 -5.0960 -7.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2260 -3.9460 -7.7080 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6260 -3.2020 -8.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9750 1.8450 0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5710 1.8330 -0.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5610 1.8100 0.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 -0.2140 2.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 -2.6740 2.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -2.6180 -2.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 -0.1590 -2.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6720 -4.5880 1.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0260 -7.6570 -2.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0380 -6.8650 -2.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2930 -5.4010 -1.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9170 -5.4770 -3.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2340 -5.0110 -5.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0890 -7.6540 -6.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5850 -8.3580 -8.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3220 -6.9830 -10.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5640 -4.8950 -10.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7430 -2.9090 -9.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2720 -3.8180 -9.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1680 -2.3090 -8.5460 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 2 0 0 0 0 8 12 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 11 12 2 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 2 0 0 0 0 16 40 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 20 43 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 44 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 27 28 2 0 0 0 0 27 47 1 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 49 1 0 0 0 0 31 50 1 0 0 0 0 31 51 1 0 0 0 0 M END