PUBCHEM-ZINC01475480 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 55 0 0 1 0 0 0 0 0999 V2000 1.0230 1.5160 -0.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5090 0.1030 -0.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6590 -0.8850 -0.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 -2.2890 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9340 -3.1480 -1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4510 -4.4410 -0.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1790 -4.8950 0.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3910 -4.0400 1.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8750 -2.7440 1.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2870 -6.1790 0.4550 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5680 -6.7030 1.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0470 -8.1400 1.5540 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8880 -8.1580 0.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4190 -8.8260 2.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1830 -10.7860 3.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3110 -11.2160 2.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8640 -12.6760 2.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0280 -13.5950 1.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7790 -13.0950 0.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2480 -11.6600 0.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0880 -10.7310 1.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -8.9350 0.9500 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3420 -8.3970 0.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6520 1.5630 -1.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1850 2.2060 -0.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6130 1.8630 0.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1460 0.0990 0.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 -0.1980 -1.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3210 -0.8730 -1.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2810 -0.5790 0.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1330 -2.8180 -2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2840 -5.0970 -1.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1920 -4.3420 2.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0300 -2.0880 2.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3510 -6.7000 2.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3540 -6.1140 2.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 -8.4410 3.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4690 -8.7000 3.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7670 -10.8760 4.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6250 -10.0580 3.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2610 -11.7400 3.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9400 -11.1340 3.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0980 -12.7330 1.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 -13.0680 3.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6520 -14.6070 1.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7190 -13.6630 2.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1270 -13.1540 -0.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6410 -13.7430 0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7360 -11.3050 -0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0010 -11.6240 1.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5060 -9.7340 1.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4140 -10.6590 0.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0970 -10.3170 2.7140 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.5090 -10.3020 1.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 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 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 22 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 14 53 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 15 53 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 16 42 1 0 0 0 0 16 53 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 21 51 1 0 0 0 0 21 52 1 0 0 0 0 22 23 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END