BWHM58 -OEChem-04012120382D 54 55 0 1 0 0 0 0 0999 V2000 7.1391 1.9081 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.1797 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.1797 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.1797 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.6797 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.6797 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.1797 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8301 2.8592 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.6797 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0613 5.3907 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8802 7.1133 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4626 6.4088 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.3203 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.5211 1.9081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8301 2.8592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2423 3.6682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.3203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.1797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.6797 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.6491 4.5817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.1797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.1797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.6797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4680 6.3043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -5.6797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -6.1797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -6.1797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -7.1797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -7.1797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -7.6797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8826 1.0388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9547 2.1603 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2111 1.3712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7283 4.0149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8116 3.2222 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6762 -1.7623 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0747 -1.0720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.9897 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 0.1303 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1631 4.2350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0798 5.0277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.9897 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 -4.0971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 -4.7874 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 0.1303 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -5.8697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -5.8697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -7.4897 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -7.4897 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -8.2997 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1324 7.6797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2636 7.0485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7147 6.9752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8270 5.9072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 13 1 0 0 0 0 2 17 2 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 4 21 1 0 0 0 0 4 45 1 0 0 0 0 5 21 2 0 0 0 0 6 22 2 0 0 0 0 7 17 1 0 0 0 0 7 18 1 0 0 0 0 7 39 1 0 0 0 0 8 15 2 0 0 0 0 19 9 1 6 0 0 0 9 22 1 0 0 0 0 9 42 1 0 0 0 0 10 20 1 0 0 0 0 10 24 2 0 0 0 0 11 24 1 0 0 0 0 11 51 1 0 0 0 0 11 52 1 0 0 0 0 12 24 1 0 0 0 0 12 53 1 0 0 0 0 12 54 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 16 20 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 21 1 0 0 0 0 19 38 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 23 25 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 26 28 1 0 0 0 0 26 46 1 0 0 0 0 27 29 2 0 0 0 0 27 47 1 0 0 0 0 28 30 2 0 0 0 0 28 48 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 30 50 1 0 0 0 0 M END $$$$