PUBCHEM-ZINC01287281 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 0 0 0 0 0 0999 V2000 3.3860 0.5540 4.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1300 -0.9060 4.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5400 -1.7460 5.2850 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4440 -1.2800 3.4130 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2900 -2.6400 3.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1410 -3.5650 4.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9890 -4.9050 3.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9840 -5.3280 2.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1330 -4.4020 1.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2800 -3.0610 1.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8310 -6.6850 2.2170 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8260 -7.1300 0.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5260 -8.6060 0.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4250 -9.2430 1.7930 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3680 -9.2180 -0.4240 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 -10.5430 -0.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9300 -11.5290 -0.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5180 -12.8720 -0.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3380 -13.7690 -0.3330 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2100 -13.1610 -0.5760 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0770 -14.0860 -0.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 -12.1750 -0.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8750 -12.4560 -0.8130 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3300 -10.8820 -0.6230 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3440 -9.8300 -0.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6250 -9.5400 -2.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5760 -8.3760 -2.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0840 -7.0970 -2.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9550 -6.0290 -2.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3190 -6.2400 -2.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8110 -7.5190 -2.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9400 -8.5870 -2.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9510 0.6600 5.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9580 0.9800 3.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4360 1.0790 4.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0580 -0.6070 2.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1450 -3.2370 5.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8740 -5.6250 4.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1290 -4.7300 0.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3900 -2.3410 0.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7270 -7.3320 2.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0630 -6.5830 0.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8030 -6.9420 0.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5200 -8.7260 -1.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9740 -11.2810 -0.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2620 -10.1600 -0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9800 -8.9240 -0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6920 -9.2970 -2.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0720 -10.4190 -2.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0180 -6.9320 -2.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5710 -5.0300 -2.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0000 -5.4050 -2.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8770 -7.6830 -2.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3240 -9.5870 -2.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 16 17 2 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 30 31 2 0 0 0 0 30 52 1 0 0 0 0 31 32 1 0 0 0 0 31 53 1 0 0 0 0 32 54 1 0 0 0 0 M END