0 mol 7 unq 0 iso 0 dist 7.21217 5.07985 6.1206 13.2513 13.2247 9.87885 16.2933 12.2333 12.8323 8.41585 numMergedOcc 0
1 mol 16 unq 0 iso 0 dist 5.84479 6.04677 8.43054 9.18436 6.92781 6.57331 5.35079 6.31718 4.65873 5.05803 numMergedOcc 0
2 mol 58 unq 0 iso 0 dist 7.84983 5.04521 9.22598 9.56737 4.81926 8.96727 11.5882 6.62496 9.87158 6.35756 numMergedOcc 0
3 mol 58 unq 1 iso 0 dist 9.56737 5.04521 8.96727 7.84983 4.81926 9.22598 11.5882 6.35756 9.87158 6.62496 numMergedOcc 0
4 mol 60 unq 0 iso 0 dist 5.83937 12.0661 7.57295 11.1212 5.67502 8.4312 9.96073 6.43294 8.62476 8.7531 numMergedOcc 0
5 mol 60 unq 1 iso 0 dist 5.83937 12.0661 7.57295 10.9217 6.54743 7.48086 6.62193 6.65595 7.80499 8.90863 numMergedOcc 0
6 mol 60 unq 2 iso 0 dist 8.82095 7.32774 7.57295 10.5768 5.67502 8.4312 13.6099 6.43294 8.62476 8.7531 numMergedOcc 0
7 mol 60 unq 3 iso 0 dist 8.82095 7.32774 7.57295 6.27749 6.54743 7.48086 5.63638 6.65595 7.80499 8.90863 numMergedOcc 0
8 mol 60 unq 4 iso 0 dist 6.27749 7.32774 7.48086 8.82095 6.54743 7.57295 5.63638 8.90863 7.80499 6.65595 numMergedOcc 0
9 mol 60 unq 5 iso 0 dist 6.27749 7.32774 7.48086 8.82095 6.54743 7.57295 5.95814 10.0828 5.6397 9.25011 numMergedOcc 0
10 mol 60 unq 6 iso 0 dist 6.27749 7.32774 7.48086 8.82095 6.54743 7.57295 13.6099 11.5843 8.62476 6.43294 numMergedOcc 0
11 mol 60 unq 7 iso 0 dist 6.27749 7.32774 7.48086 8.82095 6.54743 7.57295 12.0142 12.4757 6.55502 8.52121 numMergedOcc 0
12 mol 60 unq 8 iso 0 dist 6.27749 7.32774 7.48086 10.5768 5.00018 8.4312 13.6099 11.5843 8.62476 8.7531 numMergedOcc 0
13 mol 109 unq 0 iso 0 dist 6.31633 6.54844 9.77497 14.2617 17.2949 7.86666 18.9453 21.5605 13.0886 7.34473 numMergedOcc 0
14 mol 109 unq 1 iso 0 dist 7.21115 7.53568 9.89083 10.3063 7.15843 8.52024 11.8891 13.1098 5.00433 8.69985 numMergedOcc 0
15 mol 119 unq 0 iso 0 dist 6.49205 8.22696 8.95212 12.6552 10.9871 6.99446 13.9326 13.9919 6.20019 9.87172 numMergedOcc 0
16 mol 119 unq 1 iso 0 dist 6.49205 8.22696 8.95212 10.0583 9.93257 7.64052 13.3036 16.4353 9.68677 8.73993 numMergedOcc 0
17 mol 119 unq 2 iso 0 dist 9.42766 16.57 7.64052 15.6032 9.93257 8.95212 17.3945 9.72413 4.39676 6.18601 numMergedOcc 0
18 mol 119 unq 3 iso 0 dist 9.42766 16.57 7.64052 13.6653 4.85907 6.99446 21.9684 12.6489 6.20019 9.87172 numMergedOcc 0
19 mol 142 unq 0 iso 0 dist 7.57458 9.23267 7.81207 10.5524 5.32922 6.14151 13.1936 9.2313 4.67662 5.31024 numMergedOcc 0
20 mol 142 unq 1 iso 0 dist 7.57458 9.23267 7.81207 10.5524 5.32922 6.14151 12.288 7.73169 5.81599 7.26382 numMergedOcc 0
21 mol 152 unq 0 iso 0 dist 8.89982 9.0696 6.59889 14.5119 7.65448 6.70693 13.8698 10.399 4.94983 5.87555 numMergedOcc 0
22 mol 152 unq 1 iso 0 dist 8.89982 9.0696 6.59889 14.5119 7.65448 6.70693 13.2491 8.56324 5.39112 6.70283 numMergedOcc 0
23 mol 152 unq 2 iso 0 dist 8.89982 9.0696 6.59889 14.5119 7.65448 6.70693 18.5464 14.1618 9.67475 8.67331 numMergedOcc 0
24 mol 181 unq 0 iso 0 dist 6.43406 5.71744 5.05973 11.5992 11.5866 9.01624 11.067 9.81747 5.71898 7.81386 numMergedOcc 0
25 mol 181 unq 1 iso 0 dist 6.43406 5.71744 5.05973 11.5992 11.5866 9.01624 5.16386 9.11469 5.93724 7.63312 numMergedOcc 0
26 mol 224 unq 0 iso 0 dist 9.79616 12.65 8.79428 14.828 6.77699 6.99769 9.36962 6.60589 5.76843 6.65832 numMergedOcc 0
27 mol 224 unq 1 iso 0 dist 9.79616 12.65 8.79428 10.0081 8.49799 6.8692 5.63485 6.57273 7.05804 5.78342 numMergedOcc 0
28 mol 224 unq 2 iso 0 dist 9.79616 12.65 8.79428 10.0081 8.49799 6.8692 9.36962 6.60589 5.76843 9.16166 numMergedOcc 0
29 mol 224 unq 3 iso 0 dist 9.79616 12.65 8.79428 10.0081 8.49799 6.8692 10.3532 10.5128 4.54188 5.81334 numMergedOcc 0
30 mol 224 unq 4 iso 0 dist 9.29703 9.56183 6.8692 13.5897 11.328 6.99769 7.18448 9.16166 5.76843 6.65832 numMergedOcc 0
31 mol 224 unq 5 iso 0 dist 9.29703 9.56183 6.8692 11.1052 8.49799 8.79428 4.8786 5.78342 7.05804 6.57273 numMergedOcc 0
32 mol 224 unq 6 iso 0 dist 9.29703 9.56183 6.8692 11.1052 8.49799 8.79428 7.18448 9.16166 5.76843 6.60589 numMergedOcc 0
33 mol 238 unq 0 iso 0 dist 5.24313 12.4194 9.12776 16.0821 15.7907 9.72188 16.5687 14.6111 7.06793 5.72887 numMergedOcc 0
34 mol 238 unq 1 iso 0 dist 9.31417 13.338 9.72188 21.1413 15.7907 9.12776 23.2166 19.5656 10.3162 7.31233 numMergedOcc 0
35 mol 238 unq 2 iso 0 dist 5.56719 12.046 9.72188 19.8325 15.7907 9.12776 22.3579 19.5656 10.3162 7.31233 numMergedOcc 0
36 mol 259 unq 0 iso 0 dist 6.77279 9.90573 9.07743 9.58006 4.69778 7.66153 5.71237 8.13497 8.8603 7.88519 numMergedOcc 0
37 mol 259 unq 1 iso 0 dist 6.77279 9.90573 9.07743 9.58006 4.69778 7.66153 9.10984 9.95973 5.8801 7.84554 numMergedOcc 0
38 mol 259 unq 2 iso 0 dist 6.77279 9.90573 9.07743 9.58006 4.69778 7.66153 11.8501 10.3935 11.8896 7.46176 numMergedOcc 0
39 mol 259 unq 3 iso 0 dist 6.77279 9.90573 9.07743 9.58006 4.69778 7.66153 13.9868 12.6839 5.81576 9.18903 numMergedOcc 0
40 mol 259 unq 4 iso 0 dist 9.58006 9.90573 7.66153 6.77279 4.69778 9.07743 7.55268 10.5767 6.73882 8.53687 numMergedOcc 0
41 mol 259 unq 5 iso 0 dist 9.58006 9.90573 7.66153 6.77279 4.69778 9.07743 5.71237 7.88519 8.8603 8.13497 numMergedOcc 0
42 mol 259 unq 6 iso 0 dist 7.93997 7.06301 5.85442 9.52383 9.98105 6.9899 12.3218 11.858 7.09907 5.30224 numMergedOcc 0
43 mol 259 unq 7 iso 0 dist 7.93997 7.80863 6.95511 13.8509 6.96053 9.46361 17.4589 10.3935 12.2293 8.13497 numMergedOcc 0
44 mol 259 unq 8 iso 0 dist 7.93997 7.80863 6.95511 13.8509 6.96053 9.46361 14.8465 7.46176 11.6988 7.88519 numMergedOcc 0
45 mol 277 unq 0 iso 0 dist 9.02914 13.3706 5.46926 6.90434 7.08227 8.9682 13.2927 16.3537 17.6038 9.7748 numMergedOcc 0
46 mol 277 unq 1 iso 0 dist 9.02914 12.1739 5.13913 6.90434 7.08227 6.92711 13.2927 16.3537 14.772 9.7748 numMergedOcc 0
47 mol 277 unq 2 iso 0 dist 9.98528 19.5312 9.57499 19.4967 11.8268 8.9682 27.9111 21.4606 17.6038 9.7748 numMergedOcc 0
48 mol 280 unq 0 iso 0 dist 8.85762 7.42656 6.86234 11.1402 5.51836 6.02353 4.95798 6.0664 4.90315 6.53701 numMergedOcc 0
