D04HQK -OEChem-10101305022D 26 27 0 0 0 0 0 0 0999 V2000 4.8198 2.7362 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5411 0.9761 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.0108 3.3240 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6288 2.1484 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.6116 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.6116 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2320 1.9272 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9230 0.9761 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4076 3.5452 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.1116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 1.9272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.3884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.1116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.6116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.6116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.6116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.6116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.1116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.9216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.3016 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.3016 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.9216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.9216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.7316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1554 4.1116 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0242 3.4804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 9 1 0 0 0 0 1 11 1 0 0 0 0 2 11 1 0 0 0 0 2 12 1 0 0 0 0 5 13 2 0 0 0 0 6 12 1 0 0 0 0 6 13 1 0 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 7 11 2 0 0 0 0 8 12 2 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 10 13 1 0 0 0 0 10 14 2 0 0 0 0 10 15 1 0 0 0 0 14 16 1 0 0 0 0 14 20 1 0 0 0 0 15 17 2 0 0 0 0 15 21 1 0 0 0 0 16 18 2 0 0 0 0 16 22 1 0 0 0 0 17 18 1 0 0 0 0 17 23 1 0 0 0 0 18 24 1 0 0 0 0 M END $$$$