PUBCHEM-ZINC06470881 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 -0.1890 0.7220 1.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -0.4260 0.4830 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6140 -0.0080 -0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9310 -1.5440 1.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6460 -2.2030 0.3270 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2430 -0.9720 0.0980 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4790 -1.4260 -1.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8900 -1.9480 -1.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9230 -0.8690 -1.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7360 0.2920 -1.4720 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2690 -1.2590 -0.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1840 -2.3660 0.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4780 -3.5840 -0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1120 -3.2680 -0.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2430 -4.1440 -0.6500 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6160 -2.7750 0.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4620 -1.8770 1.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5040 -1.4600 -2.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 -0.2310 -3.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 -0.3140 -4.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1980 -1.0970 -5.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8190 -0.7950 -6.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6520 0.1130 -5.8490 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1830 0.4260 -4.5750 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0620 -1.3340 -7.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3100 -2.6760 -7.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1350 -2.6040 -7.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2240 -2.0440 -5.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1490 -2.3340 -5.1470 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7520 1.1300 1.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7330 1.5310 0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7970 0.4040 2.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9900 -2.1810 -2.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7320 -0.3620 -0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8880 -1.5770 -1.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3630 -4.3690 0.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0700 -4.0040 -0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1850 -3.1340 0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6060 -3.5790 1.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1650 -1.9290 1.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9780 -1.0150 2.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4280 -2.6640 2.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4310 -1.5730 1.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5310 -1.5270 -1.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6880 -2.3830 -2.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7610 -0.1060 -3.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4190 0.6720 -2.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 -0.6310 -8.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1300 -1.4840 -7.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3040 -3.0110 -8.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8560 -3.4350 -7.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7430 -1.9630 -7.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5710 -3.6090 -7.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 -1.6610 2.3980 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 4 5 2 0 0 0 0 4 54 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 18 1 0 0 0 0 8 9 1 0 0 0 0 8 14 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 24 2 0 0 0 0 21 22 2 0 0 0 0 21 28 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 28 29 2 0 0 0 0 M CHG 1 54 -1 M END