IBS-ZINC05269604 MOE2007 3D Structure written by MMmdl. 55 58 0 0 0 0 0 0 0 0999 V2000 -1.8630 -2.5730 -0.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6790 -1.6620 -0.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6880 -2.2890 -0.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7960 -1.6460 -0.1450 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7240 -0.2920 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6920 0.6690 0.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9970 1.8890 0.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6930 1.7400 -0.0460 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5090 0.3870 -0.1550 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7190 -0.3100 -0.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9000 0.4550 -0.4870 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7850 0.3870 -1.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2670 0.3100 -1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7160 1.3780 0.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2470 1.4880 0.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0830 1.4080 0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0310 1.6890 -1.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8510 0.7440 -1.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0610 3.0960 -1.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1060 0.3980 0.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5390 -0.7160 1.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9020 -0.9530 1.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8470 -0.0780 0.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4290 1.0360 0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0660 1.2750 -0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8100 -3.7890 -0.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7760 -3.4120 0.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7980 -2.0730 -0.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9550 -2.9700 -1.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3900 2.8890 0.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6190 1.2880 -2.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5390 -0.4650 -2.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5070 -0.6360 -0.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8930 0.4250 -2.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9160 0.4310 1.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9930 2.2160 1.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6310 1.3930 1.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0580 2.4790 0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2730 0.4310 0.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2120 2.1720 0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5490 0.9600 -2.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8610 -0.2710 -1.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0970 3.3600 -2.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8280 3.2300 -2.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2790 3.8010 -0.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8220 -1.4100 1.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2230 -1.8220 1.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9070 -0.2630 0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1630 1.7190 -0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7720 2.1470 -0.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4440 -4.2860 0.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2410 -4.1290 -1.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8580 -4.0700 -0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6250 1.4260 -0.2940 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.4540 2.3200 -0.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 10 2 0 0 0 0 3 4 2 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 7 8 2 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 13 54 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 14 54 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 16 54 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 43 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 25 2 0 0 0 0 21 22 2 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 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 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END