PUBCHEM-ZINC04005690 MOE2007 3D CORINA 3.40 0006 02.08.2006 68 71 0 0 1 0 0 0 0 0999 V2000 -0.0700 1.5180 -0.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0730 0.1660 -1.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0820 -0.4530 -1.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2430 0.2880 -1.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2500 1.6400 -1.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0930 2.2630 -0.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0990 3.7170 -0.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2610 4.4630 -0.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2640 5.8140 -0.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1090 6.4340 -0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0520 5.6930 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 4.3420 -0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1140 7.8030 0.1150 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3710 8.5550 0.0640 C 0 0 3 0 0 0 0 0 0 0 0 0 3.2040 7.8870 0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3340 9.6810 1.1020 C 0 0 3 0 0 0 0 0 0 0 0 0 2.2500 9.2530 2.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6250 10.4990 1.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4780 9.8650 1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7700 11.0300 -0.4280 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7130 11.5680 -0.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7510 9.8530 -1.4060 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6020 9.2020 -1.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5380 9.1160 -1.2390 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8360 10.3790 -2.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9360 9.2790 -3.7460 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6860 11.9140 -0.7210 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5680 11.5950 1.9170 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 10.5260 0.8490 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0770 -1.8220 -1.8170 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 -2.6380 -1.4540 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6250 -2.1580 -0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3850 -4.0250 -1.0080 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0080 -3.9310 -0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8370 -4.8910 -0.6870 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3860 -4.4530 0.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7440 -4.9520 -1.9210 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6430 -5.5210 -1.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1310 -3.5290 -2.3310 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6980 -3.0610 -1.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9480 -2.7690 -2.5850 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9870 -3.5790 -3.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4450 -2.2630 -3.9150 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0460 -5.5870 -2.9940 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4110 -6.2100 -0.3390 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1400 -4.6340 -2.0570 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9690 2.0000 -0.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9740 -0.4120 -0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1390 -0.1960 -2.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1520 2.2150 -1.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1590 3.9820 -1.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1650 6.3920 -0.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9480 6.1760 0.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9640 3.7670 -0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2870 8.2560 0.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9410 10.9580 -3.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7150 11.0160 -2.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9930 9.5390 -4.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6340 12.6820 -0.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4700 11.3300 2.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3580 10.0710 0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8420 -2.2340 -2.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3910 -3.9650 -4.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8440 -4.2320 -3.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9960 -2.2180 -4.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7660 -6.4920 -2.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1720 -6.2440 0.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9280 -4.1350 -2.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 47 1 0 0 0 0 2 3 2 0 0 0 0 2 48 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 49 1 0 0 0 0 5 6 1 0 0 0 0 5 50 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 51 1 0 0 0 0 9 10 1 0 0 0 0 9 52 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 53 1 0 0 0 0 12 54 1 0 0 0 0 13 14 1 0 0 0 0 13 55 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 24 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 29 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 28 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 27 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 25 26 1 0 0 0 0 25 56 1 0 0 0 0 25 57 1 0 0 0 0 26 58 1 0 0 0 0 27 59 1 0 0 0 0 28 60 1 0 0 0 0 29 61 1 0 0 0 0 30 31 1 0 0 0 0 30 62 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 41 1 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 33 46 1 0 0 0 0 35 36 1 0 0 0 0 35 37 1 0 0 0 0 35 45 1 0 0 0 0 37 38 1 0 0 0 0 37 39 1 0 0 0 0 37 44 1 0 0 0 0 39 40 1 0 0 0 0 39 41 1 0 0 0 0 39 42 1 0 0 0 0 42 43 1 0 0 0 0 42 63 1 0 0 0 0 42 64 1 0 0 0 0 43 65 1 0 0 0 0 44 66 1 0 0 0 0 45 67 1 0 0 0 0 46 68 1 0 0 0 0 M END