BJF52U -OEChem-04042105473D 39 42 0 0 0 0 0 0 0999 V2000 4.0725 3.5118 -0.2588 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.7520 2.5548 0.7376 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0113 1.1484 -0.1073 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2401 0.4855 -0.1147 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8039 -1.8373 0.0949 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8259 -1.4582 0.1745 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0021 1.1322 -1.1899 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6086 2.4643 0.4111 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3117 1.7856 -0.7594 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7953 3.2206 0.9955 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0568 0.1255 -0.0377 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5095 -1.1717 0.1041 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5041 -2.1441 0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1068 -0.5340 -0.0425 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5049 -0.2018 -0.1214 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9191 -3.4633 0.3098 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2685 -3.7877 0.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1774 -2.7537 0.3129 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9563 1.0306 0.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4086 -1.1122 -0.6696 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3114 1.3527 0.2755 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7637 -0.7902 -0.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2152 0.4424 -0.2727 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2271 0.1249 -1.5534 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5854 1.6624 -2.0573 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8781 2.3506 1.2231 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1203 3.0469 -0.3808 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7610 1.2375 0.0759 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0256 1.7663 -1.5889 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4658 4.1896 1.3835 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2413 2.6643 1.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1820 -4.2617 0.3643 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5922 -4.8158 0.4962 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2443 -2.9416 0.3655 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2734 1.7538 0.7917 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0871 -2.0766 -1.0553 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4673 -1.4980 -1.1736 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2733 0.6812 -0.3377 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7143 2.6090 0.6069 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 10 1 0 0 0 0 2 21 1 0 0 0 0 2 39 1 0 0 0 0 3 7 1 0 0 0 0 3 8 1 0 0 0 0 3 11 1 0 0 0 0 4 11 2 0 0 0 0 4 14 1 0 0 0 0 5 13 1 0 0 0 0 5 14 2 0 0 0 0 6 12 1 0 0 0 0 6 18 2 0 0 0 0 7 9 1 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 8 10 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 15 19 2 0 0 0 0 15 20 1 0 0 0 0 16 17 2 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 18 34 1 0 0 0 0 19 21 1 0 0 0 0 19 35 1 0 0 0 0 20 22 2 0 0 0 0 20 36 1 0 0 0 0 21 23 2 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 23 38 1 0 0 0 0 M END $$$$