PUBCHEM-ZINC06252115 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.7070 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1430 -0.9500 -1.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7550 -2.1260 -2.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0540 -2.9350 -2.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8010 -1.6390 -0.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5020 -0.8310 -0.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4140 -2.8160 -2.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5460 -1.8440 -1.9460 C 0 0 3 0 0 0 0 0 0 0 0 0 10.3780 -1.4200 -0.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8810 -2.5900 -1.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9240 -1.7120 -1.5330 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1820 -2.2230 -1.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2420 -1.4250 -1.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5200 -1.9470 -1.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7440 -3.2630 -1.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6890 -4.0590 -1.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4080 -3.5440 -1.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1150 -3.8190 -1.3540 N 0 3 0 0 0 0 0 0 0 0 0 0 19.0450 -3.1180 -0.9980 O 0 0 0 0 0 0 0 0 0 0 0 0 18.3130 -4.9780 -1.6730 O 0 5 0 0 0 0 0 0 0 0 0 0 10.5760 -0.7930 -2.9140 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 -0.1100 0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5990 -1.6640 0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3860 -1.5470 -1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2550 0.0070 -1.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8840 -1.2640 -3.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9480 -2.7530 -3.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9170 -3.8110 -2.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3160 -3.2520 -3.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6080 -1.0120 -0.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6730 -2.5010 -0.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2400 -0.5140 0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6400 0.0460 -1.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5820 -3.2390 -3.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3910 -3.6170 -1.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8270 -3.4460 -1.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0910 -2.9380 -2.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0680 -0.3970 -0.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3460 -1.3260 -0.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8670 -5.0870 -2.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5840 -4.1680 -2.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7220 -1.0970 -3.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4250 -1.6670 -1.5000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1320 -2.0980 -2.2680 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 8 54 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 9 54 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 10 55 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 11 55 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 12 54 1 0 0 0 0 13 14 1 0 0 0 0 13 45 1 0 0 0 0 13 46 1 0 0 0 0 13 55 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 27 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 20 50 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 51 1 0 0 0 0 23 52 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 27 53 1 0 0 0 0 M CHG 1 24 1 M CHG 1 26 -1 M END