LL3E0D -OEChem-05032301503D 29 30 0 0 0 0 0 0 0999 V2000 1.4936 -2.2304 -0.0073 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4974 0.8285 0.0113 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9820 2.5225 -0.0153 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4434 -0.1269 -0.0219 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2467 1.1659 0.0094 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9198 0.9525 0.0002 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9151 -0.4454 -0.0097 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8733 -0.3575 -0.0066 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8703 0.5710 -0.0121 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5352 -1.0049 -0.0201 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2282 0.2520 0.0019 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0847 -1.0124 -0.0025 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3176 -1.7808 0.0067 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 0.0214 0.0079 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6307 -1.0835 0.0181 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6755 -2.0999 0.0205 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7556 2.5165 0.0209 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2245 1.3111 -0.0014 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6578 0.8683 -0.0292 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5500 1.6106 -0.0247 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3087 -2.0689 -0.0068 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6408 -2.6233 0.0096 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0703 0.0341 0.0145 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6767 -1.3767 0.0293 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9897 -3.1396 0.0332 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3972 3.0265 -0.8768 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3865 3.0153 0.9204 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8481 2.4952 0.0272 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1614 1.5506 0.0083 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 2 0 0 0 0 2 18 1 0 0 0 0 2 29 1 0 0 0 0 3 18 2 0 0 0 0 4 7 1 0 0 0 0 4 10 1 0 0 0 0 4 19 1 0 0 0 0 5 6 1 0 0 0 0 5 14 1 0 0 0 0 5 17 1 0 0 0 0 6 8 2 0 0 0 0 7 9 1 0 0 0 0 7 13 2 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 9 11 2 0 0 0 0 9 20 1 0 0 0 0 11 15 1 0 0 0 0 11 18 1 0 0 0 0 12 14 2 0 0 0 0 12 21 1 0 0 0 0 13 16 1 0 0 0 0 13 22 1 0 0 0 0 14 23 1 0 0 0 0 15 16 2 0 0 0 0 15 24 1 0 0 0 0 16 25 1 0 0 0 0 17 26 1 0 0 0 0 17 27 1 0 0 0 0 17 28 1 0 0 0 0 M END $$$$