B3PB1L -OEChem-04022104333D 40 42 0 0 0 0 0 0 0999 V2000 -0.5656 -1.2982 0.4452 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5665 2.2028 -0.3031 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5060 1.6521 0.9099 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7247 -0.0605 0.2007 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3931 -0.6771 -0.4061 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0557 -0.0910 -0.5639 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8218 -0.4060 -0.7469 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7767 -1.1970 0.2325 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3955 0.1785 -0.8934 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4994 0.5052 0.2827 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1481 -0.2615 -0.2118 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2003 0.5080 -0.8459 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0716 -1.7782 0.3917 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7461 -2.0653 0.7315 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5782 -0.1936 -0.1071 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9408 0.8191 -0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2513 1.0327 -0.1552 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3138 -1.3742 0.0454 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6417 1.0774 -0.0518 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7039 -1.3296 0.1488 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3680 -0.1038 0.1002 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1447 2.8602 0.8894 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8823 0.0502 -1.7436 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3719 -1.3529 -0.8241 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6471 1.0353 -1.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4755 0.0413 1.2774 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9396 1.4441 0.3861 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3724 1.3866 -1.4518 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8576 -2.4319 0.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4889 -2.9169 1.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5385 -0.0955 -0.1526 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0022 1.3376 -1.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8266 -2.3462 0.0782 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1546 2.0353 -0.0913 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2647 -2.2529 0.2651 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9876 2.4744 0.9352 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5567 2.1914 1.5257 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0130 3.2320 1.4425 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5199 3.7123 0.6078 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0154 0.8662 0.1478 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 11 1 0 0 0 0 2 17 1 0 0 0 0 2 22 1 0 0 0 0 3 16 1 0 0 0 0 3 36 1 0 0 0 0 4 21 1 0 0 0 0 4 40 1 0 0 0 0 5 7 1 0 0 0 0 5 9 2 0 0 0 0 5 13 1 0 0 0 0 6 8 2 0 0 0 0 6 9 1 0 0 0 0 6 12 1 0 0 0 0 7 10 1 0 0 0 0 7 23 1 0 0 0 0 7 24 1 0 0 0 0 8 14 1 0 0 0 0 9 25 1 0 0 0 0 10 16 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 28 1 0 0 0 0 13 14 2 0 0 0 0 13 29 1 0 0 0 0 14 30 1 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 17 19 1 0 0 0 0 18 20 2 0 0 0 0 18 33 1 0 0 0 0 19 21 2 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 M END $$$$