PUBCHEM-ZINC06486869 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 52 0 0 1 0 0 0 0 0999 V2000 -0.2850 1.6960 -0.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 0.2110 -0.1330 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3930 0.0070 0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2650 -0.6230 -0.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3970 -1.3130 -1.3860 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2130 -0.5130 0.6120 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5150 -1.1960 0.6060 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.9560 -1.0620 -0.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3590 -2.6800 0.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4710 -0.5940 1.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9090 0.2390 2.4550 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9770 -0.2610 -1.1110 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3400 -0.0500 -1.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8580 0.6480 -0.1530 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1320 -0.7450 -2.1550 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7310 -0.3180 -3.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8900 -2.2660 -2.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3920 -2.9200 -3.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9170 -4.3720 -3.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3160 -5.0240 -4.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7630 -6.3580 -4.9890 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9740 -7.1270 -6.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6470 -6.7740 -7.0770 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3210 -8.4800 -6.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5420 -0.3610 -2.1530 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8500 0.2920 -2.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4690 -0.8140 -1.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2370 -1.5970 -0.3220 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8390 -0.2350 -1.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6230 2.2940 -0.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6910 1.9080 -1.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0180 2.0440 0.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0920 0.0830 1.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9160 -2.8350 1.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3240 -3.1960 0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7070 -3.1690 0.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5800 -0.7880 -1.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3470 -2.7580 -1.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8180 -2.4730 -2.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0110 -2.3650 -4.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4870 -2.8830 -3.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3280 -4.9480 -2.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8250 -4.4070 -3.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9530 -4.4390 -5.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4060 -5.0980 -4.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2090 -6.7270 -4.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3440 -8.4140 -5.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1760 -8.8700 -7.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9630 -9.1620 -5.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8140 0.8460 -1.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5510 -0.6860 -0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1670 -0.4410 -2.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6690 -0.9900 1.6350 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 12 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 53 1 0 0 0 0 12 13 1 0 0 0 0 12 37 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 17 1 0 0 0 0 15 25 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 M CHG 1 53 -1 M END