IBS-ZINC02028293 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 0 0 0 0 0 0999 V2000 0.1580 1.5000 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1360 -0.0060 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 -0.7110 -0.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1340 -2.0920 -0.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0940 -2.7730 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9240 -2.0630 0.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8980 -0.6810 0.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0000 0.0900 1.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 -4.1740 -0.0250 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2110 -4.8370 1.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3530 -4.2340 2.1890 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1860 -6.3100 1.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3210 -7.0560 2.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4350 -8.3970 2.1960 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4550 -9.1990 3.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5910 -10.6800 3.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8600 -10.9040 2.4420 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 -6.9530 -0.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0230 -8.1650 -0.3050 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1170 -6.1610 -1.2860 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0900 -4.8250 -1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2140 -4.1690 -2.2010 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3660 1.8730 -0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3330 1.8700 0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1910 1.8480 -0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9600 -0.1810 -1.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9270 -2.6420 -1.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7340 -2.5890 1.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8000 0.2860 0.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3920 -0.4930 2.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6060 1.0360 1.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3350 -6.5650 3.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5040 -8.8320 1.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3000 -8.8960 4.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4730 -9.0430 3.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5170 -11.2820 3.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2040 -10.9600 2.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0150 -11.8240 2.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2340 -6.5680 -2.1590 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 21 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 18 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 M END