D06CIE -OEChem-04152109273D 27 26 0 0 0 0 0 0 0999 V2000 2.3080 -1.0837 0.0327 S 0 0 0 0 0 0 0 0 0 0 0 0 3.9946 0.1564 0.0648 P 0 0 0 0 0 0 0 0 0 0 0 0 4.0658 1.0009 -1.3187 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3230 -0.7679 -0.0522 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0058 1.0370 1.2848 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5448 0.1874 -0.0105 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4543 0.6198 -0.0223 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8085 -0.5394 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0125 0.4049 -0.0172 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4160 -0.7325 -0.0016 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8902 0.0516 0.0219 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3514 -0.3343 0.0154 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8666 -1.1993 -0.8714 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8683 -1.1705 0.8984 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9634 1.0312 -0.9179 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9524 1.0841 0.8437 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4508 -1.3659 -0.8969 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4721 -1.3844 0.8795 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4959 0.8051 0.7992 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9496 0.6843 0.9139 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9721 0.6982 -0.8582 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4254 -0.9424 0.9235 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4297 -1.0069 -0.8454 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4059 1.2327 0.7907 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3378 0.1173 0.0512 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7394 1.7087 -1.4053 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2017 -0.3483 0.0667 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 11 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 2 0 0 0 0 3 26 1 0 0 0 0 4 27 1 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 6 19 1 0 0 0 0 7 12 1 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 14 1 0 0 0 0 9 12 1 0 0 0 0 9 15 1 0 0 0 0 9 16 1 0 0 0 0 10 11 1 0 0 0 0 10 17 1 0 0 0 0 10 18 1 0 0 0 0 11 20 1 0 0 0 0 11 21 1 0 0 0 0 12 22 1 0 0 0 0 12 23 1 0 0 0 0 M END $$$$