IBS-ZINC05177540 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 59 0 0 1 0 0 0 0 0999 V2000 -0.8760 1.3470 0.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7060 -0.1470 0.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5680 -0.8890 1.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4100 -2.2630 1.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3950 -2.8860 0.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 -2.1170 -0.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6990 -0.7290 -0.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4670 -3.0560 -1.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2960 -4.2720 -1.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2710 -4.1940 0.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1490 -5.4010 0.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3320 -6.5500 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1740 -5.5250 -2.1790 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8330 -5.6190 -2.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1940 -5.4430 -3.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3860 -4.0860 -3.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5620 -2.9470 -3.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2650 -7.9380 -1.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0590 -9.0240 -1.2020 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1010 -8.7160 -1.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9770 -10.3330 -1.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8580 -11.3670 -1.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1810 -11.4890 -1.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9880 -12.4380 -1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4730 -13.2650 -0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1500 -13.1440 0.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3410 -12.1980 -0.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5110 -9.2180 0.1030 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1030 1.8260 0.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4730 1.7040 -0.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3800 1.5910 1.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5830 -0.3770 2.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3020 -2.8290 2.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8130 -0.1400 -1.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5750 -5.2280 1.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1180 -5.6510 1.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3740 -6.3800 -0.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2560 -7.4870 0.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8950 -6.1420 -4.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1570 -5.7730 -2.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1800 -4.1810 -5.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4340 -3.8080 -3.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0250 -1.9980 -3.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4380 -3.0000 -3.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7950 -8.1900 -1.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6050 -7.8730 -2.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3130 -10.1630 -3.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -10.6870 -2.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5830 -10.8430 -2.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0220 -12.5330 -1.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1050 -14.0060 0.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7480 -13.7900 1.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3070 -12.1060 -0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4160 -9.4930 0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4740 -6.6460 -1.2660 N 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 2 0 0 0 0 8 17 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 12 55 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 55 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 18 55 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 28 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 21 48 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 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 27 53 1 0 0 0 0 28 54 1 0 0 0 0 M END