PUBCHEM-ZINC06426279 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 -0.4760 0.9100 0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3260 0.7930 2.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7660 3.0050 1.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5300 3.6400 2.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4450 5.1640 2.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1430 5.6740 3.6770 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4270 7.0200 3.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7110 7.9610 2.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0460 9.3130 2.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0920 9.7310 3.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8030 8.7990 4.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4790 7.4270 4.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2890 6.3900 5.3300 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.1280 6.9550 6.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5490 7.3440 7.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3190 7.9470 8.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6740 8.1830 8.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2750 7.8070 7.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4960 7.1690 6.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0990 6.7760 5.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4550 7.0380 4.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2180 7.6820 5.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6330 8.0570 6.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3430 6.0290 4.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8520 5.6840 2.9780 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0870 5.6590 4.3750 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4210 5.4300 5.9460 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6970 -0.1610 0.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5990 1.0900 0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0250 1.3920 -0.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 1.0380 2.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4760 -0.2820 2.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8300 1.1150 3.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1470 3.3860 0.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3100 3.2030 1.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5840 3.3350 2.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1370 3.3040 3.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3940 5.4730 2.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9040 5.5240 1.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8790 7.6770 2.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4890 10.0400 2.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3570 10.7850 3.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6170 9.1770 5.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4860 7.1840 7.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8620 8.2420 9.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2570 8.6660 9.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9300 6.7310 3.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2710 7.8810 5.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2480 8.5520 7.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7040 5.2870 5.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9560 1.5010 1.4150 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.9680 1.3160 1.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 51 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 2 51 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 51 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 10 11 2 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 26 1 0 0 0 0 13 27 1 0 0 0 0 14 15 2 0 0 0 0 14 19 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 45 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 21 22 2 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 49 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 27 50 1 0 0 0 0 51 52 1 0 0 0 0 M CHG 1 51 1 M END