IBS-ZINC05157520 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 0 0 0 0 0 0999 V2000 -0.0120 1.5430 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 0.0230 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4100 -0.5230 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9710 -0.7140 -1.2320 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2380 -1.1830 -1.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1540 -1.5110 -2.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1390 -1.4910 -3.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2850 -1.9080 -4.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4250 -2.3360 -3.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4610 -2.3640 -2.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3080 -1.9450 -1.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1490 -1.8990 -0.2050 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8870 -1.4350 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2630 -1.2150 1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9900 -0.7440 1.1810 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8820 -1.4530 2.4510 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1660 -1.1980 3.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0460 -1.5340 4.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3030 -1.2710 6.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1030 -1.5780 7.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2760 -2.0090 7.2830 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0140 1.9240 0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5140 1.9560 -0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.9210 0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5340 -0.3300 -0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5210 -0.3650 0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2570 -1.1590 -4.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2860 -1.8970 -5.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3010 -2.6540 -4.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3370 -2.6930 -1.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8310 -1.8040 2.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2540 -1.8080 3.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8700 -0.1430 3.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9650 -0.9350 4.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3560 -2.5860 4.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3880 -1.8760 6.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0010 -0.2180 6.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4690 -1.3560 8.5200 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 15 2 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 9 10 2 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 M CHG 1 38 -1 M END