B7VM5K -OEChem-04042105253D 23 23 0 1 0 0 0 0 0999 V2000 -3.1286 0.1836 0.6189 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2313 -1.1724 -0.3543 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0199 -1.7588 0.1782 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9248 1.0566 0.0112 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6795 1.0543 -1.5631 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0390 0.3664 -0.4532 C 0 0 1 0 0 0 0 0 0 0 0 0 0.1943 -0.4273 -0.8901 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0985 -0.4885 0.3510 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.4927 1.3329 0.5925 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5019 0.4805 1.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0880 -0.5393 0.1371 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4969 -0.0879 -0.0053 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7120 0.0858 -1.7124 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0386 -1.4331 -1.2578 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1179 -1.4953 0.7855 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2520 1.7651 1.2523 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0443 2.1637 0.1162 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2376 1.0981 1.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0384 -0.0915 2.1421 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8995 0.3889 -2.3039 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0332 1.7256 -1.9769 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8234 -0.3891 1.0081 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1514 -0.9302 -0.5931 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 22 1 0 0 0 0 2 12 1 0 0 0 0 2 23 1 0 0 0 0 3 11 2 0 0 0 0 4 12 2 0 0 0 0 5 6 1 0 0 0 0 5 20 1 0 0 0 0 5 21 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 13 1 0 0 0 0 7 14 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 8 15 1 0 0 0 0 9 10 1 0 0 0 0 9 16 1 0 0 0 0 9 17 1 0 0 0 0 10 18 1 0 0 0 0 10 19 1 0 0 0 0 M END $$$$