PUBCHEM-ZINC06412027 MOE2007 3D Structure written by MMmdl. 49 51 0 0 1 0 0 0 0 0999 V2000 1.3700 4.9700 -1.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4350 4.6600 -0.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9880 3.5630 0.4060 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9840 3.8970 0.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8330 2.1940 -0.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8950 1.5820 -0.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7240 0.3360 -1.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4920 -0.3210 -1.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4210 0.2600 -0.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 1.5130 -0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8550 -0.3360 -0.6740 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2760 -1.5400 -1.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6280 -2.3100 -1.9170 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7130 -1.8490 -0.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1480 -3.1650 -1.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8120 3.4620 1.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1260 3.7050 1.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9030 4.0020 0.7210 O 0 5 0 0 0 0 0 0 0 0 0 0 4.8110 3.6030 3.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1590 3.9270 3.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7350 3.8040 4.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9700 3.3710 5.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6240 3.0750 5.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0670 3.2040 4.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6980 2.9230 4.1060 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0200 3.0670 2.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 2.8560 2.8420 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4330 5.2860 -1.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7100 5.7830 -2.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 4.1020 -2.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6480 5.5880 -0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3520 4.3810 -1.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8640 2.0700 -1.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5540 -0.1270 -2.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4080 -1.2870 -1.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2190 1.9770 0.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5270 0.1920 -0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7890 -1.9000 0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3500 -1.0290 -1.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1270 -3.1280 -2.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5430 -4.0080 -1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7890 4.3030 2.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7820 4.0570 4.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4190 3.2790 6.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0120 2.7530 6.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5520 -3.4580 -1.0830 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.8710 -4.3430 -1.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1970 -2.7200 -1.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6490 -3.5460 -0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 16 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 2 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 15 46 1 0 0 0 0 16 17 2 0 0 0 0 16 26 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 2 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 46 47 1 0 0 0 0 46 48 1 0 0 0 0 46 49 1 0 0 0 0 M CHG 1 18 -1 M CHG 1 46 1 M END