PUBCHEM-ZINC05362431 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 0.5910 0.5550 1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2150 -0.8200 0.6650 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7880 -0.9590 -0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5480 -2.0380 1.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2430 -1.8040 2.5690 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2640 -0.8450 0.3550 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.1310 -0.7280 1.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5190 -0.7320 1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4070 -0.5920 2.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7940 -0.5960 2.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3070 -0.7430 0.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4230 -0.8840 -0.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0310 -0.8800 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1330 -1.0300 -1.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7490 -1.0240 -0.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8150 -1.2180 -2.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2550 -2.4770 -2.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6250 -2.6670 -3.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 -1.6040 -4.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4270 -0.3350 -3.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4750 -0.1560 -2.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6490 0.8020 -4.6570 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0070 1.0270 -5.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7850 -1.7270 -5.2780 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3690 -2.9980 -5.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6760 -0.7350 0.6870 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.2380 -0.9580 -0.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7230 -0.4610 3.1060 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2520 -0.3540 4.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6780 0.6440 1.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2440 1.3450 0.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1640 0.7440 2.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6910 -0.6340 2.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9940 -0.4800 3.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7990 -1.0000 -1.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5040 -1.1670 -2.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4940 -3.3260 -1.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0180 -3.6690 -3.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8970 0.8350 -2.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1520 2.1080 -5.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7160 0.6560 -4.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2090 0.5930 -6.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0030 -2.9000 -6.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0080 -3.3150 -4.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6020 -3.7470 -5.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9690 -0.1540 -1.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9460 -1.9370 -0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3270 -0.9540 -0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1230 -0.2770 5.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6920 -1.2480 4.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6530 0.5530 4.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -3.1270 1.1340 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 6 1 0 0 0 0 4 5 2 0 0 0 0 4 52 1 0 0 0 0 6 7 1 0 0 0 0 6 15 2 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 2 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 28 1 0 0 0 0 11 12 2 0 0 0 0 11 26 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 M CHG 1 6 1 M CHG 1 52 -1 M END