B2XPW5 -OEChem-04012117272D 51 53 0 0 0 0 0 0 0999 V2000 5.5116 -3.2710 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.1778 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 4.3222 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 4.3222 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 5.3222 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7576 -4.6142 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3563 -5.6322 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.6778 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.8222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.3222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.1778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.3222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.6778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.1778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.1778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 2.8222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.8222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.6778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.6778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.8222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 3.8222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.6778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -4.0142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7026 -4.6723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 4.3222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6808 -4.8802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.1778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.1778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1753 -3.9097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7631 -4.7187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 1.4048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8535 0.7146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5422 0.7396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9407 1.4299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6762 -0.7604 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0747 -0.0701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.9878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 2.5122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 2.5122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.0578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.2978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2419 -5.0872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9329 -5.4466 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.8678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.4878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7325 -3.6379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0044 -3.3137 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 4.0122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 4.0122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 5.6322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1220 -5.1157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 1 23 1 0 0 0 0 2 13 2 0 0 0 0 3 20 1 0 0 0 0 3 48 1 0 0 0 0 4 21 1 0 0 0 0 4 49 1 0 0 0 0 5 25 1 0 0 0 0 5 50 1 0 0 0 0 6 30 1 0 0 0 0 6 51 1 0 0 0 0 7 30 2 0 0 0 0 8 13 1 0 0 0 0 8 14 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 12 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 13 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 16 2 0 0 0 0 12 17 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 18 1 0 0 0 0 15 22 2 0 0 0 0 16 21 1 0 0 0 0 16 38 1 0 0 0 0 17 20 2 0 0 0 0 17 39 1 0 0 0 0 18 24 2 0 0 0 0 19 27 1 0 0 0 0 19 40 1 0 0 0 0 20 25 1 0 0 0 0 21 25 2 0 0 0 0 22 28 1 0 0 0 0 22 41 1 0 0 0 0 23 26 2 0 0 0 0 23 29 1 0 0 0 0 24 26 1 0 0 0 0 24 42 1 0 0 0 0 26 43 1 0 0 0 0 27 28 2 0 0 0 0 27 44 1 0 0 0 0 28 45 1 0 0 0 0 29 30 1 0 0 0 0 29 46 1 0 0 0 0 29 47 1 0 0 0 0 M END $$$$