IBS-ZINC05322935 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1990 -0.6370 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3700 0.0950 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6000 -0.5470 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6750 -1.9230 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5110 -2.6850 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2590 -2.0410 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2720 -3.0540 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9100 -4.2540 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2760 -4.0400 0.0030 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9560 -4.7320 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2540 -5.5680 -0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9610 -5.6420 -0.0670 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9970 -6.6930 -0.0540 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3420 -8.0030 -0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2760 -9.0520 0.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6120 -10.4280 0.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -9.7890 -1.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -8.3930 -1.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1800 -12.1270 -1.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 -12.5120 -2.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3620 -12.2650 -3.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 -12.6180 -4.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3060 -13.2190 -5.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8310 -13.4660 -4.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8700 -13.1170 -3.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3280 1.1740 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5080 0.0380 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6390 -2.4100 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7970 -2.9010 -0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9650 -6.6340 -0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5820 -7.9590 0.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4700 -8.8030 1.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2160 -9.0680 -0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3210 -10.4150 1.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2800 -11.1790 0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8150 -10.0760 -2.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5290 -9.7790 -0.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9460 -8.3990 -2.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6720 -7.6740 -1.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4760 -12.8110 -0.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1840 -12.1820 -0.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2190 -11.7960 -2.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2910 -12.4250 -5.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3380 -13.4940 -6.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6880 -13.9350 -4.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7570 -13.3140 -2.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3300 -10.7560 -0.9490 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 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 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 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 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 18 52 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 19 52 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 21 52 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 51 1 0 0 0 0 M END