BJN4C7 -OEChem-04042104303D 59 62 0 0 0 0 0 0 0999 V2000 -6.0270 3.4512 0.1899 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0085 3.1927 1.2096 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4808 -2.1804 1.1180 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2127 -3.2347 0.8891 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5853 -1.1245 -0.8249 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8518 0.0568 0.6237 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2576 0.3046 0.0289 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5705 2.9174 -0.9889 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0647 0.4794 -0.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8299 -0.5225 -1.4645 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5707 0.5439 0.0306 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4595 -1.8932 -1.2163 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1974 -0.8286 0.2763 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9439 -1.7802 -0.8875 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2448 0.0772 0.9303 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5926 1.8759 -0.7574 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7978 2.8909 0.3271 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0624 -1.0884 0.7425 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6225 -0.9381 0.4096 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2473 -2.0144 0.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5932 -1.8124 0.1682 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0125 -0.5275 -0.2341 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0464 0.4796 -0.2828 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5365 -2.8512 0.2293 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3589 -0.3042 -0.5666 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2824 -1.3473 -0.5004 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8722 -2.6179 -0.1033 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3358 1.8257 -0.6727 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1891 0.0145 -0.3191 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0121 0.3615 1.0203 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9742 0.8146 -1.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6203 1.5089 1.5298 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5825 1.9618 -0.6396 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4055 2.3091 0.6998 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2734 -0.1140 -2.3834 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7634 -0.6456 -1.6852 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7467 1.1471 0.9288 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1161 1.0263 -0.7915 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9388 -2.4079 -0.4015 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3326 -2.5172 -2.1087 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2777 -0.7136 0.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8036 -1.2639 1.2018 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4855 -1.4235 -1.7723 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3453 -2.7714 -0.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5501 -0.9055 1.3025 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3901 0.7639 1.7698 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5409 1.9023 -1.0632 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1433 2.2041 -1.6497 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3907 0.9312 0.3904 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2027 4.1217 0.8839 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2777 -3.8573 0.5462 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6826 0.6779 -0.9031 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3444 -3.9426 0.5309 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5895 -3.4323 -0.0472 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4238 -0.2553 1.6943 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1150 0.5491 -2.1931 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4866 1.7767 2.5738 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1939 2.5848 -1.2858 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8799 3.2018 1.0966 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 1 50 1 0 0 0 0 2 17 2 0 0 0 0 3 18 2 0 0 0 0 4 20 1 0 0 0 0 4 53 1 0 0 0 0 5 26 1 0 0 0 0 5 29 1 0 0 0 0 6 15 1 0 0 0 0 6 18 1 0 0 0 0 6 49 1 0 0 0 0 7 19 1 0 0 0 0 7 23 2 0 0 0 0 8 28 3 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 9 16 1 0 0 0 0 10 12 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 13 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 14 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 23 28 1 0 0 0 0 24 27 2 0 0 0 0 24 51 1 0 0 0 0 25 26 2 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 27 54 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 30 32 1 0 0 0 0 30 55 1 0 0 0 0 31 33 2 0 0 0 0 31 56 1 0 0 0 0 32 34 2 0 0 0 0 32 57 1 0 0 0 0 33 34 1 0 0 0 0 33 58 1 0 0 0 0 34 59 1 0 0 0 0 M END $$$$