PUBCHEM-ZINC05854900 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 1 0 0 0 0 0999 V2000 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 1.5850 -1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1330 1.8000 -2.2340 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2300 1.8160 -1.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7090 2.3100 -2.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1280 2.6100 -2.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7000 3.0680 -3.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0650 3.2220 -3.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3060 2.8560 -2.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1210 2.4790 -1.7710 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0020 2.1710 -0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6180 2.8660 -1.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6080 3.2180 -2.2750 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9790 3.3500 -5.1720 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.9160 3.1300 -5.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1880 4.8220 -5.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2830 4.6930 -7.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7480 3.3240 -7.3860 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5810 2.5440 -6.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8720 1.3680 -6.2370 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3180 2.8630 -8.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2150 2.3480 -9.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8500 1.0160 -9.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8380 0.5430 -10.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1910 1.4030 -11.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5570 2.7350 -11.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5720 3.2060 -10.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9200 2.4610 -3.4090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5230 1.4370 0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7340 0.8810 -0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8000 3.5650 -4.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1140 5.2200 -5.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3360 5.4370 -5.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0000 5.4130 -7.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3040 4.8480 -7.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0330 2.0640 -8.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8240 3.6930 -9.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3540 0.3440 -8.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5520 -0.4970 -10.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4000 1.0340 -11.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0520 3.4060 -11.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8600 4.2460 -10.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4550 2.5600 -0.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7180 2.4830 -0.3780 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6000 2.5060 0.0190 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 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 45 1 0 0 0 0 5 6 1 0 0 0 0 5 28 2 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 14 1 0 0 0 0 8 9 2 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 12 13 2 0 0 0 0 12 46 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 19 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 2 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 21 39 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 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 26 2 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 27 44 1 0 0 0 0 46 47 1 0 0 0 0 M END