IBS-ZINC05345869 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 59 0 0 0 0 0 0 0 0999 V2000 -0.5310 1.4670 0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1280 0.0330 0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -0.8630 1.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1190 -0.7420 2.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 -1.8430 3.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5140 -3.0610 2.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6730 -3.2080 1.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4230 -2.0940 0.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5110 -1.9490 -0.7210 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8100 -2.6870 -1.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1540 -0.6780 -1.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1400 -0.1910 -2.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2690 0.9950 -2.7730 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0630 -1.1630 -3.4490 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0520 -0.8320 -4.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 -2.0430 -5.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3340 -1.7150 -7.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4440 0.0090 -6.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4230 -0.3140 -5.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1330 -0.9920 -9.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5490 -0.8730 -9.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0780 0.3770 -9.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4020 0.4880 -10.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2090 -0.6460 -10.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6930 -1.8930 -10.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3690 -2.0080 -9.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0590 -1.5900 4.7230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1810 -2.6650 5.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3170 2.1130 -0.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3490 1.6780 -0.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8760 1.7340 1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4220 0.2050 2.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7090 -3.9310 3.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9830 -4.1590 1.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2570 -2.1170 -3.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6890 -0.0370 -5.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3620 -2.3740 -5.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3170 -2.8860 -5.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0600 -0.9350 -7.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5390 -2.6140 -7.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4560 0.2890 -7.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7470 0.8170 -7.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1960 -1.0610 -5.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6910 0.5850 -4.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 -1.8530 -9.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5360 -0.1040 -9.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4690 1.2770 -9.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8060 1.4600 -10.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2400 -0.5570 -10.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3230 -2.7770 -10.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9890 -2.9940 -9.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5080 -3.4960 5.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -2.9960 5.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -2.3000 6.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0360 -1.2140 -7.5800 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.7140 -1.9570 -7.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 11 2 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 7 2 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 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 35 1 0 0 0 0 15 16 1 0 0 0 0 15 19 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 39 1 0 0 0 0 17 40 1 0 0 0 0 17 55 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 18 55 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 20 55 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 24 25 2 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 55 56 1 0 0 0 0 M CHG 1 55 1 M END