PUBCHEM-ZINC05819710 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 42 0 0 1 0 0 0 0 0999 V2000 -0.6460 1.3350 0.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4530 -0.1670 0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6080 -0.6900 1.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7910 -2.2210 1.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6320 -2.6120 -0.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6510 -4.1270 -0.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4610 -4.4850 -1.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4560 -2.6940 2.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6770 -2.8720 2.3580 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6450 -2.8840 3.4410 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8020 -2.6640 3.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1510 -1.7060 4.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5520 -2.1690 5.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9550 -2.4120 5.8430 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4530 -1.4540 5.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2500 -3.3670 4.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4760 -2.9420 7.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8710 -4.1400 7.1980 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2850 1.8720 0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4070 1.6880 -0.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9720 1.5930 1.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4090 -0.6700 0.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1690 -0.3870 -0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5670 -0.1930 0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3240 -0.3920 2.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1800 -2.7160 0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 -2.1330 -1.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6610 -2.2440 -0.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0770 -4.6470 0.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6250 -4.4940 -0.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5010 -4.1590 -1.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4590 -5.5690 -1.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0410 -4.0140 -2.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2140 -2.2680 2.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2690 -3.6410 3.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7680 -0.7050 4.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2400 -1.6200 4.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7540 -1.4140 6.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0540 -3.0890 6.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8260 -4.3630 4.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3310 -3.4990 4.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4500 -2.1010 8.1290 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 16 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 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 M CHG 1 42 -1 M END