IFLAB-ZINC01784741 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 0.1390 1.5850 -0.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 0.1290 -0.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1460 -0.2640 1.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3600 -1.5950 1.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5260 -2.5500 0.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4790 -2.1750 -0.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2650 -0.8420 -1.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2100 -0.4250 -2.6430 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3450 -1.1850 -3.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5310 -2.3980 -3.8110 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2310 -0.4050 -5.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0830 -0.8550 -6.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 0.2320 -7.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2630 1.4410 -6.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5310 1.2870 -5.0140 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.3540 2.6490 -7.2920 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0780 2.6200 -8.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2510 1.4860 -9.2870 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2950 0.2170 -8.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4990 -0.8240 -9.3190 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5860 1.6370 -10.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0210 2.1480 -10.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2030 3.3540 -10.5720 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4240 -2.2700 -6.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0580 1.7070 -1.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7090 1.9960 -1.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 2.1800 0.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 0.4710 1.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3960 -1.8860 2.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6940 -3.5900 0.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6160 -2.9600 -1.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0510 0.5620 -2.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0990 3.5510 -9.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4490 0.6850 -11.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1030 2.3640 -11.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 -2.7970 -7.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1820 -2.3110 -7.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8440 -2.8160 -5.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8340 1.3140 -11.3940 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 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 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 24 1 0 0 0 0 13 14 2 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 2 0 0 0 0 21 22 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 22 23 2 0 0 0 0 22 39 1 0 0 0 0 24 36 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 M CHG 1 39 -1 M END