PUBCHEM-ZINC04691235 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 50 0 0 0 0 0 0 0 0999 V2000 0.7860 -0.1210 1.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2830 -1.4520 0.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6410 -2.5820 1.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2130 -1.3910 0.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0310 -1.2690 1.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4040 -1.2140 1.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9620 -1.2810 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1500 -1.4030 -1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7700 -1.4530 -0.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9450 -1.5710 -2.0680 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4100 -2.1590 -3.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5710 -2.5220 -3.2470 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5510 -2.3540 -4.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9930 -3.0150 -5.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3180 -3.3310 -5.5000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7550 -4.1340 -6.5610 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0720 -4.3590 -6.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8860 -3.7940 -6.0320 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5280 -5.2930 -7.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5970 -6.0280 -8.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0290 -6.8980 -9.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3820 -7.0480 -9.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3120 -6.3270 -9.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8960 -5.4500 -8.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8090 -4.7460 -7.3290 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -3.4050 -6.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8680 -0.1650 1.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5310 0.6850 0.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3170 0.0650 2.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7520 -1.6380 -0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2820 -3.5300 1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7230 -2.6260 1.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1720 -2.3960 2.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5980 -1.2160 2.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0410 -1.1190 2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0350 -1.2390 -0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5870 -1.4560 -2.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 -1.2300 -2.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4600 -1.9740 -4.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9550 -3.0000 -4.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1100 -4.5270 -7.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5410 -5.9150 -8.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3080 -7.4670 -10.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7120 -7.7310 -10.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3660 -6.4480 -9.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0370 -3.8900 -7.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3780 -4.3950 -6.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 -3.4220 -7.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7870 -2.6810 -6.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 10 11 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 2 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 26 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 2 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 25 46 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 M END