B17JHY -OEChem-04042102313D 36 38 0 0 0 0 0 0 0999 V2000 -4.9803 0.8784 0.1727 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7437 -1.9579 -0.0713 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6760 2.6218 -0.1043 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9154 1.8790 0.0026 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1095 0.3367 -0.1175 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9429 -0.3635 -0.0042 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9259 0.9791 -0.0161 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7924 -1.2675 0.0399 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3587 -0.8011 -0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3279 1.4533 -0.0832 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4715 1.6450 0.0425 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2061 -1.7102 -1.1458 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2837 -1.6877 1.2687 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1955 1.5174 -1.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1292 1.5378 1.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8888 -2.5732 -1.1027 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8113 -2.5507 1.3119 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5700 1.2838 -1.1052 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5038 1.3042 1.3096 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2242 1.1773 0.1221 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3976 -2.9936 0.1262 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1100 -0.7084 -0.6989 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1808 2.8572 -0.0415 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1220 0.3504 -0.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5913 -1.3916 -2.1114 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7299 -1.3514 2.2016 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6968 1.5999 -2.1074 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5782 1.6347 2.2021 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3464 -2.9166 -2.0257 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2083 -2.8769 2.2687 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1116 1.1946 -2.0435 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9960 1.2230 2.2756 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2514 -3.6640 0.1598 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4747 -1.4581 -0.2197 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8184 -0.6007 -1.7468 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1467 -1.0534 -0.6615 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 1 22 1 0 0 0 0 2 9 2 0 0 0 0 3 10 2 0 0 0 0 4 7 1 0 0 0 0 4 11 1 0 0 0 0 4 23 1 0 0 0 0 5 9 1 0 0 0 0 5 10 1 0 0 0 0 5 24 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 7 10 1 0 0 0 0 8 12 2 0 0 0 0 8 13 1 0 0 0 0 11 14 2 0 0 0 0 11 15 1 0 0 0 0 12 16 1 0 0 0 0 12 25 1 0 0 0 0 13 17 2 0 0 0 0 13 26 1 0 0 0 0 14 18 1 0 0 0 0 14 27 1 0 0 0 0 15 19 2 0 0 0 0 15 28 1 0 0 0 0 16 21 2 0 0 0 0 16 29 1 0 0 0 0 17 21 1 0 0 0 0 17 30 1 0 0 0 0 18 20 2 0 0 0 0 18 31 1 0 0 0 0 19 20 1 0 0 0 0 19 32 1 0 0 0 0 21 33 1 0 0 0 0 22 34 1 0 0 0 0 22 35 1 0 0 0 0 22 36 1 0 0 0 0 M END $$$$