B2G0DM -OEChem-04042104103D 26 27 0 1 0 0 0 0 0999 V2000 1.1871 -0.0323 -0.7266 S 0 0 0 0 0 0 0 0 0 0 0 0 2.8522 -1.0334 1.1087 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7354 -1.2045 -1.3842 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2336 1.2778 -1.3513 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0971 0.1568 0.8759 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5855 0.1383 0.7174 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4610 -0.3915 -0.2599 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2723 0.5775 0.3303 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 -1.6736 -0.4893 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7695 1.9604 0.5877 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5827 0.2642 0.6913 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2705 -1.9870 -0.1284 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0818 -1.0180 0.4619 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2931 2.9656 -0.4336 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6406 0.6499 1.7203 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0187 0.1524 -0.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1835 0.6268 1.4761 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1324 2.2696 1.5786 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3098 2.0584 0.6824 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3544 -2.4515 -0.9447 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2270 1.0082 1.1524 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6593 -2.9854 -0.3063 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1020 -1.2621 0.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0004 2.6981 -1.4536 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8985 3.9633 -0.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3865 3.0273 -0.4081 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 5 1 0 0 0 0 1 7 1 0 0 0 0 2 5 1 0 0 0 0 2 6 1 0 0 0 0 5 6 1 0 0 0 0 5 15 1 0 0 0 0 6 16 1 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 7 9 2 0 0 0 0 8 10 1 0 0 0 0 8 11 2 0 0 0 0 9 12 1 0 0 0 0 9 20 1 0 0 0 0 10 14 1 0 0 0 0 10 18 1 0 0 0 0 10 19 1 0 0 0 0 11 13 1 0 0 0 0 11 21 1 0 0 0 0 12 13 2 0 0 0 0 12 22 1 0 0 0 0 13 23 1 0 0 0 0 14 24 1 0 0 0 0 14 25 1 0 0 0 0 14 26 1 0 0 0 0 M END $$$$