BS86HR -OEChem-04042103083D 41 43 0 0 0 0 0 0 0999 V2000 1.5329 -2.5928 -0.4999 S 0 0 0 0 0 0 0 0 0 0 0 0 3.6639 0.8365 2.2017 F 0 0 0 0 0 0 0 0 0 0 0 0 7.4688 2.5866 -0.0006 F 0 0 0 0 0 0 0 0 0 0 0 0 1.7394 -3.8668 0.1751 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6610 -2.5224 -1.9486 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9910 2.2118 -0.6685 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5241 0.8598 1.1158 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5693 -1.4278 0.1980 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8537 0.2114 -1.1397 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8053 -0.4275 0.7644 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0013 1.1053 -0.6590 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0512 -1.9855 -0.0764 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9571 -0.6432 -0.5513 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6979 -1.0983 -0.9433 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5743 -1.0283 0.6357 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4821 -0.0222 -0.2229 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6449 -2.3905 1.1214 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9102 -1.9203 1.4946 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8127 0.6739 -0.1619 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9406 0.3080 -0.3162 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3383 1.0715 1.0676 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5225 0.9223 -1.3369 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5733 1.7177 1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7573 1.5687 -1.2825 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2829 1.9663 -0.0529 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2021 1.3429 0.0372 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2508 2.5430 -0.0728 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2566 -0.7673 -1.8765 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9097 -1.5929 1.1536 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0861 0.0491 -1.2418 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7724 0.5012 0.4288 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1331 -3.0740 1.7944 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3623 -2.2393 2.4283 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7324 0.6860 -2.0244 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1266 0.6160 -2.3015 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9083 1.5967 -1.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9825 2.0271 2.0791 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3103 1.7619 -2.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7690 3.2378 -0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0954 3.0324 0.8933 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8631 1.6436 0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 2 0 0 0 0 1 5 2 0 0 0 0 1 8 1 0 0 0 0 1 12 1 0 0 0 0 2 21 1 0 0 0 0 3 25 1 0 0 0 0 6 26 1 0 0 0 0 6 27 1 0 0 0 0 7 26 2 0 0 0 0 8 16 1 0 0 0 0 8 29 1 0 0 0 0 9 13 1 0 0 0 0 9 20 1 0 0 0 0 9 34 1 0 0 0 0 10 15 1 0 0 0 0 10 20 2 0 0 0 0 11 20 1 0 0 0 0 11 26 1 0 0 0 0 11 36 1 0 0 0 0 12 14 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 15 2 0 0 0 0 14 28 1 0 0 0 0 15 18 1 0 0 0 0 16 19 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 17 18 2 0 0 0 0 17 32 1 0 0 0 0 18 33 1 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 21 23 1 0 0 0 0 22 24 2 0 0 0 0 22 35 1 0 0 0 0 23 25 2 0 0 0 0 23 37 1 0 0 0 0 24 25 1 0 0 0 0 24 38 1 0 0 0 0 27 39 1 0 0 0 0 27 40 1 0 0 0 0 27 41 1 0 0 0 0 M END $$$$