PUBCHEM-ZINC06912785 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 54 0 0 1 0 0 0 0 0999 V2000 0.0320 -0.0500 2.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -0.7600 1.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 -0.0390 0.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 -0.6820 -1.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.0840 -1.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1430 -2.8270 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1410 -2.1610 1.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2220 -4.1930 -0.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -4.2890 -1.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 -2.9850 -2.1670 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 -2.6210 -3.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2730 -5.4720 -2.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4910 -5.4200 -3.7560 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0830 -6.6690 -1.8950 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1510 -7.9720 -2.5470 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8270 -7.9130 -3.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2380 -8.4970 -2.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9170 -7.7560 -4.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1610 -7.9400 -5.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3550 -8.2590 -4.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7610 -8.9290 -1.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6860 -8.7100 -0.3000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3420 -10.0540 -2.0610 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9320 -11.0980 -1.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2310 -12.3300 -2.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8500 -13.4640 -1.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0450 -13.2400 -0.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0040 0.0610 3.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5930 -0.6060 3.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4890 0.9420 2.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1030 1.0460 0.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 -0.0940 -2.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2000 -2.7380 2.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3170 -5.0170 0.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9590 -2.8200 -4.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8030 -3.2090 -4.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2540 -1.5630 -3.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1010 -6.6920 -0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1660 -9.5620 -3.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8960 -8.4480 -2.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9690 -6.6860 -3.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0650 -9.0010 -5.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6890 -7.4420 -6.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1570 -7.5110 -5.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9300 -8.0990 -3.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8650 -7.7250 -5.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3790 -9.3300 -4.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3770 -10.1640 -3.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8440 -10.6850 -0.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2360 -11.3260 -0.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3080 -12.7020 -2.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9200 -12.0750 -2.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0960 -14.5040 -1.9340 O 0 5 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 21 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 41 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 27 2 0 0 0 0 26 53 1 0 0 0 0 M CHG 1 53 -1 M END