IFLAB-ZINC05258534 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 45 0 0 1 0 0 0 0 0999 V2000 -0.0320 1.5440 0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 0.0140 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7340 -0.5050 1.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7590 -2.0340 1.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5140 -4.0010 2.4480 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6060 -4.3680 1.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7160 -4.4700 3.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9890 -4.0370 2.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9390 -3.4140 1.5480 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1830 -4.3420 3.1340 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3580 -4.0440 2.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3510 -3.9370 1.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5180 -3.6410 0.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7020 -3.4490 1.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7280 -3.5520 2.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5550 -3.8450 3.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5740 -3.9510 4.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5750 -4.2980 5.2230 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7010 -3.6620 5.3060 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6480 -3.7870 6.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2460 -4.5380 3.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6060 -3.7760 3.4510 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9900 1.9240 0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5590 1.9140 -0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.8830 0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0280 -0.3660 0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5060 -0.3250 -0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7550 -0.1240 1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2210 -0.1650 2.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2620 -2.4150 1.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2720 -2.3740 0.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6700 -4.0310 4.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6990 -5.5570 3.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2230 -4.7690 4.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4320 -4.0850 0.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5070 -3.5600 -0.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6090 -3.2190 0.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6540 -3.4020 2.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8860 -3.1160 7.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4000 -4.8150 7.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6170 -3.5260 7.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4690 -2.5330 2.4390 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 -2.1430 2.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 -5.8630 3.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7640 -6.1600 3.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 21 1 0 0 0 0 5 42 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 44 1 0 0 0 0 42 43 1 0 0 0 0 44 45 1 0 0 0 0 M END