D07NKJ -OEChem-05142003503D 39 42 0 0 0 0 0 0 0999 V2000 1.3449 2.8707 0.0568 S 0 0 0 0 0 0 0 0 0 0 0 0 6.7511 -0.8353 -1.1956 F 0 0 0 0 0 0 0 0 0 0 0 0 6.2543 -1.4947 0.8159 F 0 0 0 0 0 0 0 0 0 0 0 0 5.2511 -2.3797 -0.8912 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.6042 3.0423 -0.1270 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4112 -4.4863 0.5713 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8539 -2.8450 -0.9052 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7573 1.2323 1.0748 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8226 -0.0963 1.4088 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3356 0.5835 1.2486 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6755 -1.1474 -0.5503 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5497 1.5776 -1.2441 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6813 1.9670 1.7175 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6487 1.6891 1.0787 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7503 -0.8338 0.8846 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5146 0.6524 0.5208 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6993 1.8355 -0.2012 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7424 -0.3159 -0.0532 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6372 1.8568 0.1926 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6787 1.0099 -0.3884 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8147 -2.2930 1.2565 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5113 -0.3452 0.4532 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6524 -0.1338 -0.3261 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8429 2.0545 -0.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8140 1.0511 -1.0355 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7040 -1.1904 -0.3962 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3041 -3.1923 0.1765 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5514 -0.5852 -1.4081 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4896 0.7516 -1.7487 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6460 1.6668 2.7721 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9106 3.0388 1.7049 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8503 -2.5611 1.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2066 -2.4523 2.1546 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3858 -1.2718 1.0071 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9756 2.9772 -1.5425 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6992 1.2214 -1.6435 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3080 -1.2442 -1.8159 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1952 1.1986 -2.4382 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0845 -5.1064 -0.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 17 1 0 0 0 0 2 26 1 0 0 0 0 3 26 1 0 0 0 0 4 26 1 0 0 0 0 5 19 2 0 0 0 0 6 27 1 0 0 0 0 6 39 1 0 0 0 0 7 27 2 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 19 1 0 0 0 0 9 15 2 0 0 0 0 10 14 2 0 0 0 0 10 16 1 0 0 0 0 11 18 2 0 0 0 0 11 28 1 0 0 0 0 12 20 2 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 15 18 1 0 0 0 0 15 21 1 0 0 0 0 16 17 2 0 0 0 0 16 22 1 0 0 0 0 17 24 1 0 0 0 0 18 20 1 0 0 0 0 19 20 1 0 0 0 0 21 27 1 0 0 0 0 21 32 1 0 0 0 0 21 33 1 0 0 0 0 22 23 2 0 0 0 0 22 34 1 0 0 0 0 23 25 1 0 0 0 0 23 26 1 0 0 0 0 24 25 2 0 0 0 0 24 35 1 0 0 0 0 25 36 1 0 0 0 0 28 29 2 0 0 0 0 28 37 1 0 0 0 0 29 38 1 0 0 0 0 M END $$$$