L13DCK -OEChem-05022323073D 31 31 0 0 0 0 0 0 0999 V2000 -3.4362 -0.5846 0.3745 P 0 0 0 0 0 0 0 0 0 0 0 0 -1.8235 -0.6503 0.4612 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1263 2.4186 -0.7722 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1390 1.3229 0.9312 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8107 -1.7256 -0.7086 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6938 0.7929 -0.4323 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1489 -0.6910 1.6910 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3988 -1.9632 -0.4691 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0738 0.4271 0.1185 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3768 -0.6379 -0.4413 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4324 0.2985 0.3848 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0786 -0.5560 -0.7474 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3680 1.7066 0.4338 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0427 -0.9063 0.0753 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0791 -1.8009 -0.7138 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -1.0978 0.3415 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5451 3.6470 -0.5273 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3731 -1.3790 -1.4084 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3215 0.3698 -1.2772 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5753 1.5123 0.9572 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9605 2.3350 1.1093 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5935 -2.6690 -1.1487 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7170 -0.9930 1.4094 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8201 -2.1014 0.0403 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0971 -0.3797 -0.2297 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0698 1.0824 1.0568 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7059 4.1480 -1.4856 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0631 4.2973 0.1089 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5184 3.4652 -0.0612 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7556 -1.9189 -0.8868 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6139 1.1153 -0.5395 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 6 1 0 0 0 0 1 7 2 0 0 0 0 2 12 1 0 0 0 0 3 13 1 0 0 0 0 3 17 1 0 0 0 0 4 11 1 0 0 0 0 4 26 1 0 0 0 0 5 30 1 0 0 0 0 6 31 1 0 0 0 0 8 14 2 0 0 0 0 8 15 1 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 9 13 1 0 0 0 0 10 12 1 0 0 0 0 10 15 2 0 0 0 0 11 14 1 0 0 0 0 12 18 1 0 0 0 0 12 19 1 0 0 0 0 13 20 1 0 0 0 0 13 21 1 0 0 0 0 14 16 1 0 0 0 0 15 22 1 0 0 0 0 16 23 1 0 0 0 0 16 24 1 0 0 0 0 16 25 1 0 0 0 0 17 27 1 0 0 0 0 17 28 1 0 0 0 0 17 29 1 0 0 0 0 M END $$$$