PUBCHEM-ZINC04561070 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 0 0 0 0 0 0 0 0999 V2000 4.3720 -8.1980 7.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5220 -8.9010 6.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0200 -8.1960 4.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2410 -8.8380 4.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9620 -10.1910 4.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4680 -10.8960 5.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2500 -10.2500 6.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 -10.8440 3.2070 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3820 -10.6240 1.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3080 -9.9280 1.5360 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4640 -11.2430 0.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 -10.8560 -0.4730 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 -11.2950 -1.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7450 -12.0100 -1.4130 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6730 -10.8970 -2.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2190 -11.4990 -3.9310 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -10.7760 -4.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7950 -11.2400 -5.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5680 -11.0580 -3.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -12.7170 -4.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2140 -13.0760 -4.5560 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0400 -13.6160 -4.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3560 -13.1230 -4.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3830 -13.9290 -5.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1380 -15.2760 -5.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1850 -16.1300 -5.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9170 -17.4280 -6.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6180 -17.9280 -6.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5780 -17.1320 -5.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8160 -15.7840 -5.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7660 -14.9350 -5.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7340 -7.8000 7.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0820 -8.9050 7.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9150 -7.3810 6.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2380 -7.1440 4.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8490 -8.2870 3.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2520 -11.9480 5.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6470 -10.7980 7.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4740 -11.4540 3.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4950 -12.3280 0.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5540 -10.8920 1.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6750 -10.2840 -0.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6420 -9.8120 -3.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6920 -11.2480 -3.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2050 -9.7060 -4.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2960 -12.1850 -6.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8750 -11.3780 -5.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4860 -10.4900 -6.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4420 -10.4630 -2.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5120 -10.7950 -3.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5750 -12.1170 -3.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5520 -12.0910 -4.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3880 -13.5370 -5.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1970 -15.7570 -6.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7240 -18.0810 -6.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4330 -18.9620 -6.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5760 -17.5320 -5.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2460 -15.3080 -5.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 39 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 40 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 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 45 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 31 2 0 0 0 0 23 24 2 0 0 0 0 23 52 1 0 0 0 0 24 25 1 0 0 0 0 24 53 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 27 55 1 0 0 0 0 28 29 2 0 0 0 0 28 56 1 0 0 0 0 29 30 1 0 0 0 0 29 57 1 0 0 0 0 30 31 1 0 0 0 0 31 58 1 0 0 0 0 M END