L2HD0T -OEChem-05022323312D 42 45 0 0 0 0 0 0 0999 V2000 6.0409 4.0570 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.1283 4.8886 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -5.4238 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 -4.4238 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.5981 -4.4238 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.4238 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 2.4422 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7026 2.5707 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.4238 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.0762 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6808 2.7786 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.5762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.0762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3936 3.5217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.4238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5116 1.1694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.5762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.0762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.0762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 1.9126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.9238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0627 4.2649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4154 3.7296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.9238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.9238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.9238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1064 4.6807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7537 5.2159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.4238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7756 5.4238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -4.4238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6405 0.5630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.2338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 1.3862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7974 1.8478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.6138 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0006 3.2689 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.6138 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.2338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1686 5.6767 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.0438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5840 6.0135 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 2 27 1 0 0 0 0 3 31 1 0 0 0 0 4 31 1 0 0 0 0 5 31 1 0 0 0 0 6 25 1 0 0 0 0 6 31 1 0 0 0 0 7 17 2 0 0 0 0 8 11 1 0 0 0 0 8 12 1 0 0 0 0 8 14 1 0 0 0 0 9 10 1 0 0 0 0 9 15 1 0 0 0 0 9 18 1 0 0 0 0 10 13 2 0 0 0 0 11 20 2 0 0 0 0 12 13 1 0 0 0 0 12 16 2 0 0 0 0 13 17 1 0 0 0 0 14 22 2 0 0 0 0 14 23 1 0 0 0 0 15 21 2 0 0 0 0 15 24 1 0 0 0 0 16 20 1 0 0 0 0 16 32 1 0 0 0 0 17 19 1 0 0 0 0 18 19 2 0 0 0 0 18 33 1 0 0 0 0 19 34 1 0 0 0 0 20 35 1 0 0 0 0 21 25 1 0 0 0 0 21 36 1 0 0 0 0 22 28 1 0 0 0 0 23 27 2 0 0 0 0 23 37 1 0 0 0 0 24 26 2 0 0 0 0 24 38 1 0 0 0 0 25 29 2 0 0 0 0 26 29 1 0 0 0 0 26 39 1 0 0 0 0 27 30 1 0 0 0 0 28 30 2 0 0 0 0 28 40 1 0 0 0 0 29 41 1 0 0 0 0 30 42 1 0 0 0 0 M END $$$$