PUBCHEM-ZINC05510454 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 50 0 0 1 0 0 0 0 0999 V2000 1.3970 1.4250 1.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1350 -0.0690 0.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3360 -0.3610 0.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5950 -1.8650 0.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0680 -2.1560 0.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3190 -3.6330 0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1250 -4.3190 0.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3600 -5.7380 0.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1140 -6.4820 1.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8970 -6.1520 2.9040 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.6520 -5.3910 2.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6020 -7.4510 3.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2980 -8.4450 2.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3540 -7.9160 1.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8720 -8.5690 0.4530 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0210 -5.6920 4.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8470 -5.2230 5.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6340 -5.4680 6.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5060 -6.2440 7.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6460 -5.3370 8.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4770 -6.1000 8.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5360 -5.2420 9.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0050 -4.1560 9.9730 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4540 1.6100 1.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 1.9340 0.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8050 1.8710 1.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.4890 0.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 -0.5530 1.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 0.0640 1.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6270 0.1290 -0.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 -2.2900 -0.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3030 -2.3550 1.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6960 -1.7160 1.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3590 -1.6790 -0.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8090 -4.1420 -0.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6330 -3.7920 1.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8940 -6.2190 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2780 -7.5640 4.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6540 -9.4620 2.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3370 -6.4990 4.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3930 -4.8470 3.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7020 -4.5930 5.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3390 -5.0400 7.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9340 -7.0530 7.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8750 -6.7210 6.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2620 -4.4960 7.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2660 -4.9040 8.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8540 -6.9080 9.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8860 -6.5640 7.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6120 -5.7450 9.7000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 9 2 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 2 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 2 0 0 0 0 16 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 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 22 23 2 0 0 0 0 22 50 1 0 0 0 0 M CHG 1 50 -1 M END