PUBCHEM-ZINC06225920 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 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 -1.4120 -0.5260 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0130 -0.8690 1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3100 -1.3480 1.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0090 -1.4840 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4120 -1.1410 -1.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1130 -0.6560 -1.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5250 -0.3130 -2.3540 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3070 -0.4740 -3.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4960 -0.0470 -4.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3660 0.3530 -4.5890 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0310 -0.1120 -5.9660 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1930 0.3160 -7.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9550 0.1740 -8.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2510 -0.3050 -8.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9510 -0.4350 -9.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3560 -0.0880 -10.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0590 0.3900 -10.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3580 0.5290 -9.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0860 1.0100 -9.5670 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6030 1.0120 -10.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2630 1.5710 -11.8160 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4160 0.7570 -12.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3400 -0.9460 -9.5230 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.8650 -1.2520 -8.4680 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9580 -1.0610 -10.5670 O 0 5 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4690 -0.7640 2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7780 -1.6160 2.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0220 -1.8580 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9590 -1.2480 -2.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5920 -1.5200 -3.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2040 0.1420 -3.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9080 1.3580 -6.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2960 -0.3040 -7.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7170 -0.5770 -7.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9050 -0.1900 -11.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5060 1.6160 -10.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 -0.0090 -11.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1270 -0.1510 -12.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1240 1.3220 -12.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 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 41 1 0 0 0 0 17 18 1 0 0 0 0 17 25 1 0 0 0 0 18 19 2 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 M CHG 1 25 1 M CHG 1 27 -1 M END