0 mol 17 unq 0 iso 0 dist 8.62221 9.84476 3.14198 5.89633 7.324 10.0827 numMergedOcc 0
1 mol 17 unq 1 iso 0 dist 8.62221 9.84476 3.14198 10.787 7.18716 9.80531 numMergedOcc 0
2 mol 55 unq 0 iso 0 dist 6.91288 8.77395 5.43051 5.35556 6.58179 10.4609 numMergedOcc 0
3 mol 55 unq 1 iso 0 dist 6.91288 8.60087 8.93213 5.35556 6.58179 11.537 numMergedOcc 0
4 mol 123 unq 0 iso 0 dist 5.80266 8.09329 9.29446 7.66722 7.41568 13.1748 numMergedOcc 0
5 mol 123 unq 1 iso 0 dist 5.18305 6.13025 7.48549 7.63835 8.09682 13.1748 numMergedOcc 0
6 mol 123 unq 2 iso 0 dist 5.18305 6.78431 8.29136 7.63835 8.09682 7.41568 numMergedOcc 0
7 mol 123 unq 3 iso 0 dist 6.78431 5.18305 8.29136 7.63835 7.41568 8.09682 numMergedOcc 0
8 mol 123 unq 4 iso 0 dist 6.78431 6.13025 9.29446 7.63835 7.41568 13.1748 numMergedOcc 0
9 mol 165 unq 0 iso 0 dist 6.4503 6.72652 4.90692 9.33429 7.84854 10.0458 numMergedOcc 0
10 mol 184 unq 0 iso 0 dist 8.20517 9.35481 14.6266 10.3615 5.86468 18.4765 numMergedOcc 0
11 mol 184 unq 1 iso 0 dist 8.20517 9.11936 8.05894 10.3615 5.86468 13.6484 numMergedOcc 0
12 mol 184 unq 2 iso 0 dist 9.15923 7.79098 8.04915 11.4233 5.86468 8.73302 numMergedOcc 0
13 mol 184 unq 3 iso 0 dist 7.79098 9.15923 8.04915 11.4233 8.73302 5.86468 numMergedOcc 0
14 mol 184 unq 4 iso 0 dist 6.03505 6.30144 8.04915 4.96558 5.86468 8.73302 numMergedOcc 0
15 mol 184 unq 5 iso 0 dist 6.30144 6.03505 8.04915 4.96558 8.73302 5.86468 numMergedOcc 0
16 mol 212 unq 0 iso 0 dist 8.69747 9.27163 3.62594 5.77283 8.13391 8.4285 numMergedOcc 0
17 mol 212 unq 1 iso 0 dist 8.69747 9.27163 3.62594 10.1864 9.10717 9.63444 numMergedOcc 0
18 mol 212 unq 2 iso 0 dist 9.27163 8.69747 3.62594 5.77283 8.4285 8.13391 numMergedOcc 0
19 mol 254 unq 0 iso 0 dist 8.4346 7.97728 2.67738 9.97876 7.94753 9.99046 numMergedOcc 0
20 mol 254 unq 1 iso 0 dist 7.97728 8.4346 2.67738 9.97876 9.99046 7.94753 numMergedOcc 0
21 mol 266 unq 0 iso 0 dist 7.48115 9.02396 3.00605 10.5306 7.43884 9.82944 numMergedOcc 0
22 mol 287 unq 0 iso 0 dist 6.23874 6.68956 4.68872 8.62795 9.03468 12.0096 numMergedOcc 0
23 mol 287 unq 1 iso 0 dist 6.23874 6.68956 4.68872 11.5033 6.05363 9.51547 numMergedOcc 0
24 mol 288 unq 0 iso 0 dist 6.23874 6.68956 4.68872 8.62795 9.03468 12.0096 numMergedOcc 0
25 mol 288 unq 1 iso 0 dist 6.23874 6.68956 4.68872 11.5033 6.05363 9.51547 numMergedOcc 0
26 mol 289 unq 0 iso 0 dist 6.23874 6.68956 4.68872 8.62795 9.03468 12.0096 numMergedOcc 0
27 mol 289 unq 1 iso 0 dist 6.23874 6.68956 4.68872 11.5033 6.05363 9.51547 numMergedOcc 0
28 mol 294 unq 0 iso 0 dist 5.00754 6.70519 4.59062 4.9798 4.83062 5.18334 numMergedOcc 0
29 mol 294 unq 1 iso 0 dist 5.00754 6.70519 4.59062 6.13274 8.65363 6.44588 numMergedOcc 0
30 mol 294 unq 2 iso 0 dist 6.70519 5.00754 4.59062 4.9798 5.18334 4.83062 numMergedOcc 0
31 mol 294 unq 3 iso 0 dist 6.70519 5.00754 4.59062 6.13274 6.44588 8.65363 numMergedOcc 0
