0 mol 10 unq 0 iso 0 dist 9.27096 6.41686 7.99404 10.1923 9.1686 7.76098 numMergedOcc 0
1 mol 10 unq 1 iso 0 dist 9.27096 6.41686 7.99404 14.0162 8.99402 8.20812 numMergedOcc 0
2 mol 10 unq 2 iso 0 dist 9.27096 6.41686 7.99404 5.66953 7.3489 9.87224 numMergedOcc 0
3 mol 37 unq 0 iso 0 dist 8.19078 7.33499 8.98177 10.4654 9.25986 9.45747 numMergedOcc 0
4 mol 51 unq 0 iso 0 dist 4.97772 5.46557 6.50216 5.44083 7.95419 10.8401 numMergedOcc 0
5 mol 61 unq 0 iso 0 dist 9.19647 5.92597 9.82315 9.74788 4.628 9.53688 numMergedOcc 0
6 mol 76 unq 0 iso 0 dist 8.99189 3.98395 9.06225 10.6821 7.02854 8.04327 numMergedOcc 0
7 mol 76 unq 1 iso 0 dist 8.94097 10.3277 9.06225 10.205 7.02854 8.04327 numMergedOcc 0
8 mol 79 unq 0 iso 0 dist 7.83159 8.97165 8.71103 12.342 7.41952 6.05149 numMergedOcc 0
9 mol 100 unq 0 iso 0 dist 9.15823 4.42733 6.97361 5.41923 5.61016 6.46237 numMergedOcc 0
10 mol 100 unq 1 iso 0 dist 9.63401 10.0068 6.97361 5.50494 5.61016 6.46237 numMergedOcc 0
11 mol 109 unq 0 iso 0 dist 8.41492 4.72156 7.66832 8.98907 8.59182 9.79203 numMergedOcc 0
12 mol 109 unq 1 iso 0 dist 8.41492 3.90222 8.11083 8.98907 8.59182 5.26073 numMergedOcc 0
13 mol 120 unq 0 iso 0 dist 9.79589 4.9142 9.12964 8.1011 9.18835 5.65554 numMergedOcc 0
14 mol 120 unq 1 iso 0 dist 9.66306 3.55317 9.12964 4.30031 9.18835 5.65554 numMergedOcc 0
15 mol 120 unq 2 iso 0 dist 8.84182 4.53716 9.12964 9.03773 9.18835 5.65554 numMergedOcc 0
16 mol 136 unq 0 iso 0 dist 9.73117 4.90618 9.87222 9.57467 9.33635 10.7093 numMergedOcc 0
17 mol 230 unq 0 iso 0 dist 6.05795 6.29318 8.74076 7.03151 6.23346 5.06139 numMergedOcc 0
18 mol 239 unq 0 iso 0 dist 9.64616 14.3595 8.68803 11.1473 9.59937 6.54316 numMergedOcc 0
19 mol 245 unq 0 iso 0 dist 8.22293 4.96719 5.48167 9.9568 8.69377 5.43086 numMergedOcc 0
20 mol 245 unq 1 iso 0 dist 9.34253 5.93689 5.48167 5.24264 8.69377 5.43086 numMergedOcc 0
21 mol 249 unq 0 iso 0 dist 7.34573 8.05633 7.279 7.19081 4.46389 5.4063 numMergedOcc 0
22 mol 249 unq 1 iso 0 dist 7.34573 6.09778 8.43448 7.19081 4.46389 5.26413 numMergedOcc 0
23 mol 257 unq 0 iso 0 dist 6.82161 6.83442 9.02271 8.61689 8.98346 6.69682 numMergedOcc 0
24 mol 257 unq 1 iso 0 dist 5.97154 6.62684 9.02271 5.74054 8.98346 6.69682 numMergedOcc 0
25 mol 257 unq 2 iso 0 dist 8.4903 10.5563 9.02271 5.13566 8.98346 6.69682 numMergedOcc 0
26 mol 257 unq 3 iso 0 dist 8.04644 11.8018 9.02271 8.69639 8.98346 6.69682 numMergedOcc 0
27 mol 258 unq 0 iso 0 dist 8.94629 11.4452 9.4886 11.7794 8.57305 12.1075 numMergedOcc 0
28 mol 264 unq 0 iso 0 dist 5.11475 10.4615 8.05522 5.17977 7.61232 11.7681 numMergedOcc 0
29 mol 264 unq 1 iso 0 dist 5.11475 9.34577 9.8799 5.17977 7.61232 4.93509 numMergedOcc 0
