LM31QE -OEChem-05032301332D 31 32 0 0 0 0 0 0 0999 V2000 2.8660 -1.1012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.1012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.1012 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.3988 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.8988 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 2.2352 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4128 3.1012 0.0000 N 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 -2.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -3.1012 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 7.2437 1.4921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4347 2.8933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -1.2912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.7212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -2.9112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 0.2088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0201 -3.6382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -3.4112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6401 -2.5643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 1.7088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3726 0.8856 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9739 3.3082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -1.0643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.9112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -2.1382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 18 1 0 0 0 0 2 15 2 0 0 0 0 3 8 1 0 0 0 0 3 15 1 0 0 0 0 3 22 1 0 0 0 0 4 5 1 0 0 0 0 4 15 1 0 0 0 0 4 26 1 0 0 0 0 5 16 1 0 0 0 0 5 17 1 0 0 0 0 6 7 1 0 0 0 0 6 16 2 0 0 0 0 7 17 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 9 14 1 0 0 0 0 10 13 1 0 0 0 0 11 19 1 0 0 0 0 12 13 2 0 0 0 0 12 20 1 0 0 0 0 13 21 1 0 0 0 0 14 23 1 0 0 0 0 14 24 1 0 0 0 0 14 25 1 0 0 0 0 16 27 1 0 0 0 0 17 28 1 0 0 0 0 18 29 1 0 0 0 0 18 30 1 0 0 0 0 18 31 1 0 0 0 0 M END $$$$