IFLAB-ZINC05258860 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 38 0 0 1 0 0 0 0 0999 V2000 1.3900 1.6750 0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8810 0.3670 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1230 -0.6460 -0.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1150 -0.2750 -1.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6200 0.9840 -1.0610 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 1.9300 -0.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5220 -2.0020 -0.6430 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7040 -2.5540 -0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6130 -1.9780 0.4150 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8040 -4.0530 -0.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2520 -4.5280 -0.6050 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6670 -4.1980 -1.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2210 -6.0740 -0.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6560 -6.4150 0.6940 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5910 -3.9010 0.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4080 -3.7870 1.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9000 -3.8710 1.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9680 2.4730 0.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8550 0.1780 0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7690 -1.0020 -1.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2740 2.9310 -0.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8600 -2.6270 -1.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3300 -4.5450 0.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2210 -4.3290 -1.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7340 -3.0370 -0.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8440 -4.8190 -0.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1780 -2.8420 1.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1300 -4.5940 2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1650 -4.8110 0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2450 -3.0270 0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8330 -6.7400 -1.4440 O 0 5 0 0 0 0 0 0 0 0 0 0 5.1480 -3.9590 0.5030 N 0 3 0 0 0 0 0 0 0 0 0 0 4.7650 -3.0420 0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0100 -4.6980 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6600 -3.8320 2.4140 N 0 3 0 0 0 0 0 0 0 0 0 0 10.6730 -3.9150 2.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3950 -4.6050 3.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5060 -2.9520 2.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 18 1 0 0 0 0 2 3 2 0 0 0 0 2 19 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 6 21 1 0 0 0 0 7 8 1 0 0 0 0 7 22 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 23 1 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 32 1 0 0 0 0 13 14 2 0 0 0 0 13 31 1 0 0 0 0 15 16 1 0 0 0 0 15 25 1 0 0 0 0 15 26 1 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 27 1 0 0 0 0 16 28 1 0 0 0 0 17 29 1 0 0 0 0 17 30 1 0 0 0 0 17 35 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 35 36 1 0 0 0 0 35 37 1 0 0 0 0 35 38 1 0 0 0 0 M CHG 1 31 -1 M CHG 1 32 1 M CHG 1 35 1 M END