D06VBQ -OEChem-10121500102D 46 48 0 0 0 0 0 0 0999 V2000 5.4641 2.3988 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 3.2352 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.8988 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9641 3.2648 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9641 1.5328 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4026 1.2049 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7084 0.8448 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.8988 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.1012 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.8988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.8988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2437 2.4920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4347 3.8933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4128 4.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4516 1.5139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -4.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -2.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -3.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1458 1.8740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 2.2088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.7088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -0.9112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.9112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9739 4.3082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 -2.4112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6650 4.6676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 -3.9112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.4812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 0.9357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.0888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -0.1382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -4.7212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -2.2912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -3.9112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5607 1.4133 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6065 2.2889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7309 2.3348 0.0000 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 11 1 0 0 0 0 2 16 1 0 0 0 0 2 20 1 0 0 0 0 3 12 1 0 0 0 0 3 24 1 0 0 0 0 6 21 1 0 0 0 0 6 28 1 0 0 0 0 7 21 2 0 0 0 0 8 10 1 0 0 0 0 8 29 1 0 0 0 0 9 13 1 0 0 0 0 9 19 1 0 0 0 0 9 34 1 0 0 0 0 10 12 2 0 0 0 0 10 14 1 0 0 0 0 11 16 2 0 0 0 0 11 18 1 0 0 0 0 12 15 1 0 0 0 0 13 15 2 0 0 0 0 13 17 1 0 0 0 0 14 17 2 0 0 0 0 14 30 1 0 0 0 0 15 31 1 0 0 0 0 16 21 1 0 0 0 0 17 32 1 0 0 0 0 18 20 2 0 0 0 0 18 33 1 0 0 0 0 19 22 2 0 0 0 0 19 23 1 0 0 0 0 20 35 1 0 0 0 0 22 25 1 0 0 0 0 22 36 1 0 0 0 0 23 26 2 0 0 0 0 23 37 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 25 27 2 0 0 0 0 25 41 1 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 27 43 1 0 0 0 0 28 44 1 0 0 0 0 28 45 1 0 0 0 0 28 46 1 0 0 0 0 M END $$$$