B8U2RS -OEChem-04042102023D 28 30 0 0 0 0 0 0 0999 V2000 2.9103 -1.9606 1.1623 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.6983 -0.3263 -0.7856 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8454 2.5572 1.4181 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7669 -0.8835 0.2682 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8233 0.0135 -0.1054 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6410 -0.7338 -0.0012 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0659 -0.4600 0.3274 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2185 -1.9854 0.9551 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3319 0.3744 0.4886 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7834 1.2406 -0.8106 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3129 -1.6988 -0.7516 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2543 0.2537 0.0762 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6946 0.5180 0.2278 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6756 -1.5553 -1.0124 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9604 1.9507 -1.0618 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3664 -0.4468 -0.5227 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1817 1.4608 -0.6216 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3986 1.6816 0.7492 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6438 -2.8106 1.3544 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8051 1.1207 1.0801 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8399 1.6436 -1.1702 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7925 -2.5677 -1.1479 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2149 -0.1224 0.4166 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1861 -2.3143 -1.5991 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9168 2.8904 -1.6052 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0917 2.0201 -0.8215 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4746 1.7647 0.5244 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9877 -1.0882 -1.3164 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 8 1 0 0 0 0 2 16 1 0 0 0 0 2 28 1 0 0 0 0 3 18 2 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 8 2 0 0 0 0 5 7 1 0 0 0 0 5 10 2 0 0 0 0 6 9 2 0 0 0 0 6 11 1 0 0 0 0 7 12 2 0 0 0 0 8 19 1 0 0 0 0 9 13 1 0 0 0 0 9 20 1 0 0 0 0 10 15 1 0 0 0 0 10 21 1 0 0 0 0 11 14 2 0 0 0 0 11 22 1 0 0 0 0 12 17 1 0 0 0 0 12 23 1 0 0 0 0 13 16 2 0 0 0 0 13 18 1 0 0 0 0 14 16 1 0 0 0 0 14 24 1 0 0 0 0 15 17 2 0 0 0 0 15 25 1 0 0 0 0 17 26 1 0 0 0 0 18 27 1 0 0 0 0 M END $$$$