IFLAB-ZINC05258726 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 47 0 0 1 0 0 0 0 0999 V2000 -2.4040 1.6130 1.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1570 0.1400 1.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3430 -0.0600 0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 -0.5140 -1.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6460 -2.0100 0.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0770 -2.5240 0.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4090 -4.4850 1.4270 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.0830 -3.9820 0.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4110 -5.9880 1.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0690 -6.2240 -0.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8460 -5.2830 -1.0400 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0120 -7.4820 -0.7900 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6180 -7.7060 -2.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7930 -6.7140 -3.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4030 -6.9360 -4.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8380 -8.1480 -4.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6610 -9.1400 -3.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0450 -8.9200 -2.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8670 -9.8860 -1.5490 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.4590 -8.3630 -6.0150 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.8690 -4.2420 2.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1390 -3.6860 3.6270 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7660 2.1300 2.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4720 2.0710 1.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1480 1.6870 0.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 0.0650 2.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0890 -0.3190 2.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4100 -0.4580 0.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3340 1.0290 0.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 -1.6000 -1.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8320 -0.1920 -1.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9100 -0.0710 -1.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0690 -2.2400 1.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1860 -2.4940 -0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5650 -1.9790 1.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6300 -2.3710 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6720 -6.4800 1.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3990 -6.3970 1.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2440 -8.2310 -0.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2350 -5.7680 -2.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5400 -6.1640 -5.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2200 -10.0850 -4.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6680 -0.5570 0.5570 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0480 -3.9570 1.2570 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5440 -4.4760 0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0900 -4.6440 3.2280 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3410 -4.4660 4.1440 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 26 1 0 0 0 0 2 27 1 0 0 0 0 2 43 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 3 43 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 5 43 1 0 0 0 0 6 35 1 0 0 0 0 6 36 1 0 0 0 0 6 44 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 21 1 0 0 0 0 7 44 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 21 22 2 0 0 0 0 21 46 1 0 0 0 0 44 45 1 0 0 0 0 46 47 1 0 0 0 0 M END