PUBCHEM-ZINC05434320 MOE2007 3D CORINA 3.40 0006 02.08.2006 72 76 0 0 1 0 0 0 0 0999 V2000 0.1910 1.1970 -1.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -0.2690 -1.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0120 -0.9790 -0.9770 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1850 -0.7860 -0.8350 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2580 -2.2080 -0.5400 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4190 -2.7070 -1.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1200 -2.4220 0.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3220 -1.7990 1.6660 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4060 -0.7490 1.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1530 -1.8370 3.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2990 -1.0550 3.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6510 -1.6450 3.4310 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.4190 -0.8960 3.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9410 -2.9090 4.2340 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.1310 -3.6400 4.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1950 -2.4600 5.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6760 -2.0320 5.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3340 -2.6230 4.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4630 -2.4280 4.1160 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2990 -3.5080 3.8440 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.5140 -3.6420 2.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1290 -2.4160 1.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7860 -1.8220 1.9370 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.7860 -0.7830 1.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6090 -2.5220 1.2600 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.7860 -2.4070 -0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5640 -2.7780 -1.0710 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.7090 -2.3450 -2.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4530 -4.2300 -1.2620 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.2400 -4.8890 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2750 -6.0630 -0.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3450 -5.4360 -1.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3010 -4.5290 -2.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6830 -4.7430 -1.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5360 -3.9920 1.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4060 -4.9060 4.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2470 1.4310 -1.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3530 1.4340 -2.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2090 1.7880 -0.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0290 -3.4780 1.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2080 -1.9180 1.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1380 -2.8560 3.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2060 -1.3550 3.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1830 -1.0750 4.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2490 -0.0130 3.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0170 -3.2860 6.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5530 -1.6170 5.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1590 -2.4160 6.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7520 -0.9440 5.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0080 -4.5310 1.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5940 -3.8240 2.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1290 -2.6690 0.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9070 -1.6450 1.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6230 -3.0540 -0.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0800 -1.3750 -0.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7830 -4.1940 0.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1840 -5.2650 0.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7120 -6.3440 0.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8160 -6.9180 -0.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4420 -4.8460 -0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 -6.2090 -1.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6390 -5.0480 -3.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7930 -3.6040 -2.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9020 -4.1720 -2.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5480 -5.7940 -2.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5100 -4.6450 -1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9950 -4.1270 2.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0680 -4.5950 0.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4930 -4.3060 1.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3300 -4.8270 5.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3660 -5.3500 4.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5990 -5.5340 4.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 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 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 27 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 25 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 44 1 0 0 0 0 11 45 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 23 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 20 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 17 48 1 0 0 0 0 17 49 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 22 23 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 35 1 0 0 0 0 26 27 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 33 1 0 0 0 0 29 34 1 0 0 0 0 30 31 1 0 0 0 0 30 56 1 0 0 0 0 30 57 1 0 0 0 0 31 32 1 0 0 0 0 31 58 1 0 0 0 0 31 59 1 0 0 0 0 32 33 1 0 0 0 0 32 60 1 0 0 0 0 32 61 1 0 0 0 0 33 62 1 0 0 0 0 33 63 1 0 0 0 0 34 64 1 0 0 0 0 34 65 1 0 0 0 0 34 66 1 0 0 0 0 35 67 1 0 0 0 0 35 68 1 0 0 0 0 35 69 1 0 0 0 0 36 70 1 0 0 0 0 36 71 1 0 0 0 0 36 72 1 0 0 0 0 M CHG 1 29 1 M END