L9KC4J -OEChem-05022323213D 57 60 0 0 0 0 0 0 0999 V2000 -5.6601 2.3644 -0.3184 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9060 0.9829 0.2923 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0627 -1.8510 0.0295 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4754 1.6589 -0.1364 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2727 -0.6527 -0.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8862 -1.0207 -0.7807 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1338 0.1917 1.0253 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0195 0.2279 -0.9633 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2264 1.4008 0.7835 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0350 2.1443 0.1141 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4014 -1.4881 0.4954 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1495 -2.6921 -1.1646 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5807 1.7556 0.0875 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0158 1.0919 1.1768 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7981 2.0599 -1.0262 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1144 1.0371 0.0382 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3317 0.7327 1.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5495 1.7006 -1.0509 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5395 0.6561 0.0118 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9168 -0.6293 0.1143 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3403 -0.9699 0.0752 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2978 0.0444 -0.0737 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8468 1.4548 -0.1879 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7624 -2.2992 0.1831 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6606 -0.2650 -0.1142 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1233 -2.6084 0.1429 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0691 -1.5942 -0.0054 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8001 -3.4334 0.3436 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7760 -0.0406 -1.0074 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3816 -1.7169 -0.0973 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9457 -1.5082 -1.7601 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0991 0.5852 1.3614 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7237 -0.4126 1.8458 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0321 -0.1049 -1.3043 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4436 0.8539 -1.7599 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7064 2.0891 0.0752 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1175 1.9356 1.7351 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1452 2.8377 0.9598 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3134 2.7200 -0.7788 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0335 -2.3809 0.5767 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3844 -1.0685 1.5057 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9052 -0.7867 -0.1797 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8518 -3.5188 -1.0006 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4926 -2.1372 -2.0455 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1965 -3.1808 -1.3906 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6113 0.8541 2.0543 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2253 2.5748 -1.8826 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7550 0.2215 2.0133 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1433 1.9422 -1.9292 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1788 -1.4165 0.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1360 2.6142 -0.2095 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4134 0.5097 -0.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4670 -3.6364 0.2255 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1267 -1.8400 -0.0363 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1276 -3.4931 -0.5186 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2141 -3.3149 1.2611 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3135 -4.3988 0.4156 H 0 0 0 0 0 0 0 0 0 0 0 0 1 23 2 0 0 0 0 2 8 1 0 0 0 0 2 9 1 0 0 0 0 2 10 1 0 0 0 0 3 5 1 0 0 0 0 3 11 1 0 0 0 0 3 12 1 0 0 0 0 4 19 1 0 0 0 0 4 23 1 0 0 0 0 4 51 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 29 1 0 0 0 0 6 8 1 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 7 9 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 13 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 14 17 1 0 0 0 0 14 46 1 0 0 0 0 15 18 2 0 0 0 0 15 47 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 17 48 1 0 0 0 0 18 49 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 50 1 0 0 0 0 21 22 1 0 0 0 0 21 24 2 0 0 0 0 22 23 1 0 0 0 0 22 25 2 0 0 0 0 24 26 1 0 0 0 0 24 28 1 0 0 0 0 25 27 1 0 0 0 0 25 52 1 0 0 0 0 26 27 2 0 0 0 0 26 53 1 0 0 0 0 27 54 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 M END $$$$