PUBCHEM-ZINC05728171 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 0 0 0 0 0 0999 V2000 0.0070 1.4820 0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 -0.0320 0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4070 -0.5330 0.0370 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1250 -0.7830 -1.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8390 -0.6400 -2.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8420 -1.0080 -3.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0730 -1.4960 -2.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3410 -1.6290 -1.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3470 -1.2640 -0.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3760 -1.2980 0.7180 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2020 -0.8450 1.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8580 -0.7080 2.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6820 -1.0570 3.4500 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2360 -0.8740 4.7130 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0540 -1.2190 5.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3380 -1.7550 5.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1250 -2.0870 6.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6350 -1.8860 8.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3550 -1.3520 8.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5780 -1.0240 7.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8210 -1.1330 9.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6510 -0.6450 9.7350 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0460 1.8240 0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4850 1.9560 -0.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4920 1.8360 1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4730 -0.3700 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4630 -0.5010 0.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8860 -0.2600 -2.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6570 -0.9120 -4.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8340 -1.7750 -3.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2960 -2.0050 -1.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8670 -0.2910 2.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3210 -0.4910 4.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7320 -1.9170 4.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1180 -2.5020 6.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2540 -2.1480 8.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5840 -0.6090 7.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5820 -1.4530 10.5940 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 11 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 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 2 0 0 0 0 M CHG 1 22 -1 M END