D0R4DK -OEChem-10101305032D 27 28 0 0 0 0 0 0 0999 V2000 4.6261 1.0094 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.5282 0.3913 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.7306 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0570 1.3184 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 2.2694 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 1.3184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3692 1.6785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 2.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3203 1.3695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0634 2.0386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.4594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.4594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6603 2.2259 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8807 2.0602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7304 2.7710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.0794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.0794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.8894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4783 1.5778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5242 2.4534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6486 2.4993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 10 1 0 0 0 0 2 15 2 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 5 11 1 0 0 0 0 6 8 2 0 0 0 0 6 9 1 0 0 0 0 7 11 2 0 0 0 0 8 12 1 0 0 0 0 8 17 1 0 0 0 0 9 13 2 0 0 0 0 9 18 1 0 0 0 0 10 15 1 0 0 0 0 10 19 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 13 14 1 0 0 0 0 13 23 1 0 0 0 0 14 24 1 0 0 0 0 15 16 1 0 0 0 0 16 25 1 0 0 0 0 16 26 1 0 0 0 0 16 27 1 0 0 0 0 M END $$$$