B5CWR2 -OEChem-04012119342D 28 29 0 1 0 0 0 0 0999 V2000 2.0000 2.1739 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5411 -1.4139 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6443 -3.1739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8198 -3.1739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.1739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.1739 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.6739 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.8261 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9230 -1.4139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2320 -2.3649 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2320 -2.3649 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8660 0.6739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.6739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.6739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.1739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.1739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2845 -0.5446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6130 -0.8769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3566 -1.6660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6197 -2.2679 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9506 -2.9173 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 0.3639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0277 -3.1091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4364 -3.1091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.7939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6200 3.1739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.7939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 3.1739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 16 1 0 0 0 0 2 8 1 0 0 0 0 2 11 1 0 0 0 0 3 10 1 0 0 0 0 3 23 1 0 0 0 0 4 11 1 0 0 0 0 4 24 1 0 0 0 0 5 13 2 0 0 0 0 6 8 1 0 0 0 0 6 12 1 0 0 0 0 6 13 1 0 0 0 0 7 13 1 0 0 0 0 7 15 2 0 0 0 0 8 9 1 0 0 0 0 8 17 1 0 0 0 0 9 10 1 0 0 0 0 9 18 1 0 0 0 0 9 19 1 0 0 0 0 10 11 1 0 0 0 0 10 20 1 0 0 0 0 11 21 1 0 0 0 0 12 14 2 0 0 0 0 12 22 1 0 0 0 0 14 15 1 0 0 0 0 15 25 1 0 0 0 0 16 26 1 0 0 0 0 16 27 1 0 0 0 0 16 28 1 0 0 0 0 M END $$$$