B6M5QE -OEChem-04022105443D 46 46 0 1 0 0 0 0 0999 V2000 -1.0412 1.3007 -1.9810 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2945 -2.0884 1.0575 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5490 -3.3728 -0.6122 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2739 0.0722 -0.1697 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9142 3.3926 0.0518 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9545 0.0668 0.7716 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8753 0.5446 -0.5892 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0333 0.5320 1.6845 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3638 -0.9648 -0.9405 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8239 -0.6382 -1.2665 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7191 -0.4602 -0.0344 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5525 2.0911 0.2516 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.0678 2.2130 0.0335 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9350 1.1375 -0.7665 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1442 -0.0961 -0.4367 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7960 0.9049 0.2357 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2191 -2.2735 -0.1868 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9845 0.0381 -0.8409 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2795 0.5635 1.4988 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6566 -1.1699 -0.6544 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9516 -0.6445 1.6852 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1400 -1.5111 0.6086 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2052 0.3624 0.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1975 -1.0814 -1.8756 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8576 0.2805 -1.8662 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2385 -1.4394 -1.8915 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3515 1.7516 1.2742 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3171 0.3267 0.6153 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7339 -1.3819 0.5594 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2152 0.0246 0.8434 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2866 2.5862 -0.9768 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4868 2.9626 0.7188 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5552 -0.8941 -1.0669 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1306 0.8371 -1.0128 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3103 4.0707 0.7018 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0767 3.3253 0.2817 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6231 0.2926 -1.8332 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1367 1.2294 2.3457 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8050 -1.8439 -1.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3275 -0.9107 2.6687 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3722 -2.9330 1.5502 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6634 -2.4516 0.7537 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8630 0.7754 -0.6023 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4152 0.4582 -1.4883 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0139 0.7644 1.5719 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6838 0.4303 2.6311 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 2 0 0 0 0 2 17 1 0 0 0 0 2 41 1 0 0 0 0 3 17 2 0 0 0 0 4 9 1 0 0 0 0 4 14 1 0 0 0 0 4 30 1 0 0 0 0 5 12 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 15 1 0 0 0 0 6 23 2 0 0 0 0 7 23 1 0 0 0 0 7 43 1 0 0 0 0 7 44 1 0 0 0 0 8 23 1 0 0 0 0 8 45 1 0 0 0 0 8 46 1 0 0 0 0 9 10 1 0 0 0 0 9 17 1 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 10 26 1 0 0 0 0 11 15 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 27 1 0 0 0 0 13 16 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 18 20 1 0 0 0 0 18 37 1 0 0 0 0 19 21 2 0 0 0 0 19 38 1 0 0 0 0 20 22 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 42 1 0 0 0 0 M END $$$$