PUBCHEM-ZINC06762458 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 58 0 0 1 0 0 0 0 0999 V2000 1.6160 -1.6050 0.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4020 -0.7380 0.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5650 0.6500 0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9220 -1.3700 0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2490 -2.7430 0.8390 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4940 -3.4740 0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5390 -3.2150 0.3970 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7250 -3.8770 -0.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8260 -4.1490 -1.5840 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1670 -4.2940 -1.0890 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.6760 -4.6050 -0.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9020 -3.1200 -1.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3110 -3.4560 -2.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3070 -3.7270 -1.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5960 -4.0780 -1.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8950 -4.1510 -3.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9250 -3.8730 -3.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6350 -3.5240 -3.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1660 -4.4990 -3.3660 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.2360 -4.4730 -4.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7880 -6.7900 -1.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9360 -7.9270 -2.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8860 -8.2700 -3.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0470 -9.3000 -4.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2550 -9.9900 -4.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3060 -9.6520 -3.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1510 -8.6230 -2.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3210 -2.7230 2.2980 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4640 -1.9070 2.6840 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5460 -1.1000 0.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5890 -2.5570 0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6630 -1.8200 -0.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3670 -0.6050 1.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6150 0.5890 -1.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2770 1.2990 0.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4810 1.1340 0.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7440 -0.6720 0.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8990 -1.4700 -0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2920 -2.9950 1.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9470 -2.2660 -1.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3230 -2.7650 -2.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0990 -3.6610 -0.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3680 -4.2870 -0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1530 -3.9190 -5.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8890 -3.3020 -4.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4420 -6.9320 -0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7550 -6.7070 -1.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9340 -7.7450 -3.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2300 -9.5680 -4.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3780 -10.7920 -4.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2480 -10.1910 -3.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9860 -8.3760 -1.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5850 -3.6530 2.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0460 -1.2720 3.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1630 -5.4950 -2.0170 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.0790 -5.6100 -2.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4810 -5.3060 -2.7690 H 0 0 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 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 28 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 55 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 21 55 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 26 2 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 29 54 1 0 0 0 0 55 56 1 0 0 0 0 55 57 1 0 0 0 0 M CHG 1 55 1 M END