IBS-ZINC02258384 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 0 0 0 0 0 0999 V2000 0.0780 1.5020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 -0.0040 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1570 -0.7730 1.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 -2.1270 0.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0900 -2.4450 -0.7320 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 -0.7320 -1.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2480 -0.1740 -2.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6220 0.8230 -2.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4800 1.3400 -4.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5220 0.8730 -5.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3880 -0.1140 -4.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2530 -0.6440 -3.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -3.0970 1.9180 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1250 -4.4020 1.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 -4.7260 0.4260 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2220 -5.4570 2.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1200 -6.8440 2.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2180 -7.9150 3.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 -9.2810 2.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2630 -9.9320 2.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 -11.1840 1.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 -11.7870 1.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2130 -11.1320 1.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1180 -9.8820 2.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1560 -13.0190 0.7530 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4640 -13.5790 0.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3190 -0.1890 2.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6600 0.0770 3.1640 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5540 0.0540 2.9780 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6390 0.6330 4.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0920 1.8440 -0.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5950 1.8820 -0.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2410 1.8710 0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4040 1.1880 -2.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 2.1110 -4.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6300 1.2810 -6.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1680 -0.4740 -5.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9270 -1.4180 -2.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3000 -2.8370 2.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 -5.3640 3.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5910 -5.3260 3.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8350 -6.9360 1.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9330 -6.9750 1.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 -7.8220 3.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5950 -7.7840 3.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2270 -9.4620 2.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0680 -11.6920 1.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1780 -11.5990 1.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0100 -9.3740 2.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9170 -13.6780 1.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0800 -12.9250 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3940 -14.5610 0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6860 0.7770 4.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 1.5950 4.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 -0.0370 5.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 6 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 13 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 M END