IBS-ZINC02028300 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 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 0.6120 -11.5160 4.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 -12.8990 4.0050 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 -0.2540 -10.9820 2.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5190 -10.8350 2.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4570 -11.2140 4.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3150 -11.3610 4.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7600 -13.4900 4.7700 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 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 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 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 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 29 1 0 0 0 0 7 8 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 22 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 19 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 M END