IBS-ZINC06624222 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 0.5610 1.4910 -0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4810 -0.0140 -0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7670 -0.6990 1.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6980 -2.0900 1.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3300 -2.7960 -0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2620 -4.2570 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5600 -4.8750 1.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9210 -4.1040 2.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1860 -4.6680 3.3190 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9810 -2.7650 2.2180 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5030 -6.3780 1.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8780 -6.9490 1.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8120 -6.2080 0.7900 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0700 -8.2820 1.0560 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4070 -8.8370 0.8300 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9310 -8.2310 0.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2840 -10.2510 0.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1270 -10.7040 -0.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0150 -12.0020 -1.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0600 -12.8460 -0.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2170 -12.3940 0.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3330 -11.0980 0.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1790 -8.8310 2.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6650 -8.4070 3.1320 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1270 -5.0550 -1.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 -2.0970 -1.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1080 -0.6970 -1.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 -0.2810 -2.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5180 -1.4080 -3.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3360 -2.4760 -2.4930 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3340 1.1290 -3.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5330 1.8000 -0.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2260 1.8920 -0.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4340 1.8690 0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0500 -0.1580 1.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1550 -6.6630 2.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1840 -6.7660 0.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3230 -8.8740 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8740 -10.0440 -1.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6730 -12.3550 -1.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9720 -13.8600 -0.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4710 -13.0540 0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6770 -10.7450 1.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7660 -5.3020 -1.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6250 -5.9730 -0.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 -4.4660 -1.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8200 -1.4510 -4.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6590 1.4520 -3.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0140 1.1640 -3.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 1.7910 -2.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4370 -9.2980 2.1570 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8920 -9.2740 3.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 27 2 0 0 0 0 3 4 2 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 26 2 0 0 0 0 6 7 2 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 23 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 51 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 28 31 1 0 0 0 0 29 30 1 0 0 0 0 29 47 1 0 0 0 0 31 48 1 0 0 0 0 31 49 1 0 0 0 0 31 50 1 0 0 0 0 51 52 1 0 0 0 0 M END