IBS-ZINC05429346 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 1 0 0 0 0 0999 V2000 0.7250 -0.4640 1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0050 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7360 -0.5450 -1.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 -0.5260 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4740 0.3580 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7700 -0.1170 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0070 -1.4840 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9390 -2.3700 0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6440 -1.8890 0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3220 -1.9690 0.0430 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8470 -2.6610 -0.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2690 -2.9460 -2.0030 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2760 -3.0310 -0.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4880 -2.4270 0.7600 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.7130 -3.2100 1.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1550 -1.7840 1.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8850 -1.1920 2.0980 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.1760 -1.2770 2.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2870 -0.2270 1.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9170 -0.0760 3.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0210 -0.6990 3.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2920 -0.3140 5.0810 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.0390 -0.6300 5.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3440 0.5900 5.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4380 0.7740 4.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3560 1.6430 4.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1800 2.3080 5.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0690 2.1280 6.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1480 1.2810 6.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7480 -0.0870 1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2030 -0.0800 2.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 -1.5540 1.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 1.0850 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7510 -1.6340 -1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2210 -0.2170 -2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7580 -0.1670 -1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2890 1.4220 -0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6000 0.5750 -0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1200 -3.4340 0.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8120 -2.5780 0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9650 -2.5860 -1.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3950 -4.1140 -0.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4200 -0.9610 2.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5980 -2.2320 2.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8650 0.7280 1.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0430 -0.5430 1.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6090 -1.4000 3.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6610 1.7880 3.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3430 2.9800 5.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9160 2.6610 7.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8330 1.1450 7.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5620 -1.4250 0.7340 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.2200 -0.5380 0.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 16 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 52 1 0 0 0 0 16 17 2 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 18 52 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 21 2 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 28 2 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 29 51 1 0 0 0 0 52 53 1 0 0 0 0 M END