IFLAB-ZINC00072129 MOE2007 3D Structure written by MMmdl. 44 47 0 0 1 0 0 0 0 0999 V2000 1.3390 6.7290 0.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7530 5.6540 1.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3540 5.9320 2.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2140 4.9220 3.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 3.3670 1.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 4.3660 0.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2810 2.0800 1.3390 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 1.5310 0.0040 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0330 1.8440 -0.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8570 2.0530 -1.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4940 2.1740 -2.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5360 2.7110 -3.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6660 2.9870 -2.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4690 2.5960 -0.8950 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 0.0090 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1000 -0.7850 -0.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 -2.0970 -0.2670 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3190 -2.8930 -0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5230 -2.1900 0.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9990 -0.8890 0.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2970 -0.7200 0.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0580 -1.8430 1.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5480 -3.1260 1.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2700 -3.3240 0.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4340 -0.4210 -0.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5460 7.2220 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8580 7.4810 1.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0720 6.3110 -0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4820 6.9240 3.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 5.0620 4.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8380 4.1610 -0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6890 1.4080 1.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4780 1.8850 -2.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4610 2.8840 -4.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6010 3.3980 -2.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7230 0.2670 1.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0580 -1.7100 1.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1530 -3.9880 1.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8750 -4.3260 0.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0020 0.1580 -0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0210 -1.3080 -1.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3210 0.1830 -1.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3820 3.7000 2.9860 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.8020 2.9770 3.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 30 1 0 0 0 0 4 43 2 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 5 43 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 15 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 2 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 15 16 2 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 25 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 21 22 1 0 0 0 0 21 36 1 0 0 0 0 22 23 2 0 0 0 0 22 37 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 24 39 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 43 44 1 0 0 0 0 M CHG 1 43 1 M END