B1UMP9 -OEChem-04042102023D 33 34 0 0 0 0 0 0 0999 V2000 -4.5742 0.3542 -0.3035 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3523 0.2035 -0.6384 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0291 2.0118 -0.1109 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7920 3.1711 -0.6993 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.1123 2.8171 1.4434 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9487 -2.1395 -0.7748 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7684 2.4209 0.3048 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.5407 -0.5410 0.1406 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8632 -0.8550 0.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9832 0.7728 0.2954 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4519 -1.5527 -0.1626 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3369 1.0749 0.1469 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8055 -1.2505 -0.3114 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8306 0.0982 -0.0232 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2481 0.0633 -0.1566 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2493 -2.1119 0.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1841 -0.2053 0.1245 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6027 -2.4155 0.9085 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5701 -1.4622 0.5905 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7386 -2.3236 -0.6279 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1933 0.7883 -0.2065 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4255 1.0813 -0.9956 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3032 1.5785 0.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1316 -2.5797 -0.3203 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5614 1.0729 -0.4227 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5325 -2.8747 1.0523 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9034 -3.3905 1.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6161 -1.7227 0.7294 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3144 -3.3365 -0.7346 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0683 -0.4028 -0.6503 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1231 1.7288 -1.8239 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7289 1.6772 -0.1298 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2728 0.4700 -1.3171 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 1 30 1 0 0 0 0 2 21 1 0 0 0 0 2 22 1 0 0 0 0 3 21 2 0 0 0 0 4 7 1 0 0 0 0 5 7 2 0 0 0 0 6 20 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 2 0 0 0 0 9 14 2 0 0 0 0 9 16 1 0 0 0 0 10 12 2 0 0 0 0 10 23 1 0 0 0 0 11 13 1 0 0 0 0 11 24 1 0 0 0 0 12 15 1 0 0 0 0 13 15 2 0 0 0 0 13 20 1 0 0 0 0 14 17 1 0 0 0 0 14 25 1 0 0 0 0 16 18 2 0 0 0 0 16 26 1 0 0 0 0 17 19 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 27 1 0 0 0 0 19 28 1 0 0 0 0 20 29 1 0 0 0 0 22 31 1 0 0 0 0 22 32 1 0 0 0 0 22 33 1 0 0 0 0 M CHG 2 4 -1 7 1 M END $$$$