BR8NM0 -OEChem-04022104143D 45 49 0 1 0 0 0 0 0999 V2000 4.2122 -2.1597 0.7419 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0852 -1.3074 -0.4544 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1077 0.0011 -0.8152 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7682 -1.7168 -0.6242 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5057 0.1989 -0.4371 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6225 -0.9250 0.3601 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0610 1.3973 1.1584 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7607 1.0197 -1.2358 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1510 -1.1455 -0.0374 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5905 1.1721 0.7597 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2881 0.7968 -1.6273 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6908 0.0508 1.5479 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3852 -0.3255 -0.8331 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8258 1.9855 -0.0399 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5386 -0.9487 0.0772 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0383 -0.8188 0.0434 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3658 0.5555 0.7064 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8484 1.7336 -0.1068 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6141 0.4480 -0.1376 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1104 -0.1825 0.3052 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8322 0.1707 0.6486 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1129 2.0900 2.0058 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3089 1.4437 -2.0844 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6738 -1.6320 0.8218 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0974 -1.8696 -0.8626 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0474 0.7967 1.6348 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1317 2.1356 0.4995 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2396 0.1270 -2.4962 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8429 1.7509 -1.9389 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7334 0.1916 1.8612 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1753 -0.3763 2.4179 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3708 -1.0225 -1.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4444 -0.1948 -0.5761 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3965 2.9557 -0.3184 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8716 2.1676 0.2369 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0441 -0.3482 -1.7713 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1629 -2.7630 -0.0191 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2799 -1.9801 -0.1959 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2695 -0.8031 1.1301 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5246 0.6150 1.7793 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2977 2.0126 -0.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2843 2.5687 0.4282 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5671 0.4158 0.3767 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5825 -0.1323 -1.0518 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5201 1.0149 1.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 1 6 1 0 0 0 0 1 37 1 0 0 0 0 2 4 1 0 0 0 0 2 20 1 0 0 0 0 3 5 1 0 0 0 0 3 15 1 0 0 0 0 3 36 1 0 0 0 0 4 16 2 0 0 0 0 5 9 1 0 0 0 0 5 10 1 0 0 0 0 5 11 1 0 0 0 0 6 9 1 0 0 0 0 6 12 1 0 0 0 0 6 13 1 0 0 0 0 7 10 1 0 0 0 0 7 12 1 0 0 0 0 7 14 1 0 0 0 0 7 22 1 0 0 0 0 8 11 1 0 0 0 0 8 13 1 0 0 0 0 8 14 1 0 0 0 0 8 23 1 0 0 0 0 9 24 1 0 0 0 0 9 25 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 2 0 0 0 0 21 45 1 0 0 0 0 M END $$$$