PUBCHEM-ZINC06459567 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 59 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7450 -0.5490 1.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1580 -0.7120 0.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3670 -0.8900 1.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5300 -1.0060 0.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4770 -0.9430 -0.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2660 -0.7670 -1.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0870 -0.6530 -0.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8010 -0.4970 -1.0870 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2220 -0.7060 -2.7630 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4640 -0.8300 -3.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2200 -0.7380 -4.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0030 -0.5640 -5.5240 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1540 -0.4790 -5.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1970 -0.5320 -6.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3500 -0.3820 -7.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8680 -0.3920 -9.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2310 -0.5520 -9.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0850 -0.7020 -8.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5770 -0.6930 -7.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1490 -0.8090 -5.8620 N 0 3 0 0 0 0 0 0 0 0 0 0 6.4980 -0.9780 -5.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1430 -2.1380 -6.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4910 -2.3040 -5.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2040 -1.3180 -5.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5650 -0.1620 -4.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2180 0.0130 -4.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5320 -1.4840 -4.9020 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2060 -0.4300 -4.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4200 -0.5630 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7140 0.1700 2.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3320 -1.5090 1.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4060 -0.9390 2.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4780 -1.1450 1.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3860 -1.0300 -1.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.0270 -3.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9180 -1.7920 -3.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2880 -0.2580 -7.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2080 -0.2750 -10.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6240 -0.5590 -10.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1450 -0.8260 -8.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5880 -2.9060 -6.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9910 -3.2030 -6.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1220 0.6040 -4.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7220 0.9150 -4.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1240 0.4920 -4.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7490 -0.2880 -3.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2570 -0.6890 -4.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9080 -0.2020 -0.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3820 -1.6520 -0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9840 -0.2330 0.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 10 1 0 0 0 0 2 31 1 0 0 0 0 3 4 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 39 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 22 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 M CHG 1 22 1 M END