IFLAB-ZINC02455609 MOE2007 3D Structure written by MMmdl. 40 42 0 0 0 0 0 0 0 0999 V2000 -1.3170 -1.1760 5.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3360 -0.0760 5.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 1.0580 4.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9720 1.7770 5.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6620 2.9780 5.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6660 3.4080 6.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9870 2.6640 7.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3190 1.4720 7.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3190 1.0550 6.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5110 -0.0550 6.7570 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5410 -0.7570 7.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7650 1.4600 3.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 0.9480 2.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0490 0.9860 -0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 1.5640 -1.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7860 0.8780 -1.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4140 1.4740 -3.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0820 2.6870 -3.4880 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0730 3.3350 -2.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3820 2.8250 -1.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3090 -1.5240 4.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0890 -2.0340 6.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3260 -0.8270 5.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4210 3.5740 4.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1970 4.3340 5.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7680 3.0160 7.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5690 0.8960 8.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8460 2.5530 3.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7930 1.0780 3.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 -0.1470 2.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0090 1.3280 2.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 -0.1090 -0.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9970 1.3120 -0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1100 -0.1030 -1.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2270 0.9750 -3.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8260 4.3070 -3.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4200 3.4070 -1.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7070 1.4230 1.1790 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.7570 2.4510 1.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6830 1.0960 1.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 12 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 6 25 1 0 0 0 0 7 8 2 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 37 1 0 0 0 0 38 39 1 0 0 0 0 38 40 1 0 0 0 0 M CHG 1 38 1 M END