IFLAB-ZINC02722132 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 43 0 0 0 0 0 0 0 0999 V2000 2.8300 0.7300 -0.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1120 -0.5770 -0.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3930 -1.3630 0.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7330 -2.5400 0.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8150 -2.9600 -0.2360 N 0 3 0 0 0 0 0 0 0 0 0 0 0.5180 -2.2340 -1.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1590 -1.0180 -1.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4500 -2.9010 -2.0380 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8550 -2.6070 -2.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7370 -4.0700 -1.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -4.0880 -0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 -5.0980 0.7270 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4050 -4.8600 1.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9450 -3.7990 2.2090 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2800 -5.8870 3.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7810 -5.6430 4.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6610 -6.6050 5.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0450 -7.8140 4.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4550 -8.0620 3.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3350 -7.1090 2.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -8.7540 5.9550 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.7120 -5.0980 -1.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8580 -5.6050 -3.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8450 -6.5620 -3.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5020 -6.8420 -1.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8680 -5.8700 -0.6680 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7340 0.5540 -1.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1770 1.4160 -1.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0970 1.1650 0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1320 -1.0400 1.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9540 -3.1450 1.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9160 -0.4290 -2.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4460 -5.9700 0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2610 -4.7010 4.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0480 -6.4170 6.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9350 -9.0050 3.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7200 -7.3050 1.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2520 -5.2850 -3.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0700 -7.0490 -4.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3010 -7.5620 -1.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 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 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 22 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 33 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 20 2 0 0 0 0 16 17 2 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 37 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 24 25 2 0 0 0 0 24 39 1 0 0 0 0 25 26 1 0 0 0 0 25 40 1 0 0 0 0 M CHG 1 5 1 M END