IFLAB-ZINC05152961 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 -0.1960 -0.1460 1.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2260 -0.1430 -0.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8130 -1.0670 -1.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5710 -1.7800 -0.3760 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8240 -1.0720 -2.4080 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7870 -1.8230 -3.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8340 -3.3560 -2.9450 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7970 -3.6860 -2.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 -4.0990 -4.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9520 -5.1860 -4.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9370 -5.4300 -5.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9110 -4.4770 -5.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5890 -3.6630 -4.6070 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0510 -3.5450 -1.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5610 -3.5150 -0.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0040 -4.6350 0.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6400 -4.9780 1.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1240 -5.9910 2.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9680 -6.6670 2.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3200 -6.3270 1.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8230 -5.3020 0.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1170 -4.9710 -1.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3930 -1.1490 1.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7810 0.1760 1.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9560 0.5330 1.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2150 -0.4590 -0.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0430 0.8720 -0.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1430 -0.5000 -2.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4960 -1.6380 -4.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7660 -1.3570 -3.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0360 -5.7390 -4.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9380 -6.2040 -6.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8440 -4.2550 -6.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3300 -2.6230 -2.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4500 -4.4080 -2.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6560 -3.5710 -0.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2860 -2.5620 0.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5410 -4.4570 2.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6260 -6.2530 3.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5710 -7.4590 2.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4180 -6.8680 0.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3160 -5.7570 -1.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0380 -4.8910 -0.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5460 -3.6600 -1.6230 N 0 3 0 0 0 0 0 0 0 0 0 0 2.2000 -2.9200 -0.9560 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 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 44 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 11 12 2 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 44 45 1 0 0 0 0 M CHG 1 44 1 M END