0 mol 85 unq 0 iso 0 dist 9.24862 5.12943 9.66549 7.59157 5.99046 7.40161 numMergedOcc 0
1 mol 91 unq 0 iso 0 dist 9.19143 11.301 7.62621 11.2906 4.86532 10.4949 numMergedOcc 0
2 mol 91 unq 1 iso 0 dist 9.23907 15.2345 7.62621 9.98867 4.86532 10.4949 numMergedOcc 0
3 mol 93 unq 0 iso 0 dist 7.76517 15.9692 8.84466 4.85096 6.70158 12.9548 numMergedOcc 0
4 mol 93 unq 1 iso 0 dist 7.76517 15.9692 8.84466 7.09134 7.29701 15.595 numMergedOcc 0
5 mol 93 unq 2 iso 0 dist 7.76517 10.9626 9.2948 4.85096 6.70158 13.6308 numMergedOcc 0
6 mol 93 unq 3 iso 0 dist 7.76517 10.9626 9.2948 7.09134 7.29701 4.38413 numMergedOcc 0
7 mol 167 unq 0 iso 0 dist 7.62006 6.01114 9.38623 10.4145 9.83216 12.7343 numMergedOcc 0
8 mol 173 unq 0 iso 0 dist 9.56189 8.12636 7.76856 5.9052 6.07708 5.04427 numMergedOcc 0
9 mol 218 unq 0 iso 0 dist 6.43416 7.26513 7.38022 5.3192 8.88206 4.87337 numMergedOcc 0
10 mol 238 unq 0 iso 0 dist 7.24101 12.8379 8.92585 10.0472 6.62283 5.18265 numMergedOcc 0
11 mol 238 unq 1 iso 0 dist 7.24101 12.8379 8.92585 10.0651 8.60978 4.30687 numMergedOcc 0
12 mol 287 unq 0 iso 0 dist 7.80478 13.0637 8.19213 11.5984 8.58448 8.99712 numMergedOcc 0
13 mol 287 unq 1 iso 0 dist 7.80478 7.33382 5.80664 11.5984 8.58448 4.3442 numMergedOcc 0
14 mol 287 unq 2 iso 0 dist 9.22409 7.05717 8.19213 8.8314 8.58448 8.99712 numMergedOcc 0
15 mol 287 unq 3 iso 0 dist 9.22409 10.4033 5.80664 8.8314 8.58448 4.3442 numMergedOcc 0
16 mol 288 unq 0 iso 0 dist 7.80478 13.0637 8.19213 11.5984 8.58448 8.99712 numMergedOcc 0
17 mol 288 unq 1 iso 0 dist 7.80478 7.33382 5.80664 11.5984 8.58448 4.3442 numMergedOcc 0
18 mol 288 unq 2 iso 0 dist 9.22409 7.05717 8.19213 8.8314 8.58448 8.99712 numMergedOcc 0
19 mol 288 unq 3 iso 0 dist 9.22409 10.4033 5.80664 8.8314 8.58448 4.3442 numMergedOcc 0
20 mol 289 unq 0 iso 0 dist 7.80478 13.0637 8.19213 11.5984 8.58448 8.99712 numMergedOcc 0
21 mol 289 unq 1 iso 0 dist 7.80478 7.33382 5.80664 11.5984 8.58448 4.3442 numMergedOcc 0
22 mol 289 unq 2 iso 0 dist 9.22409 7.05717 8.19213 8.8314 8.58448 8.99712 numMergedOcc 0
23 mol 289 unq 3 iso 0 dist 9.22409 10.4033 5.80664 8.8314 8.58448 4.3442 numMergedOcc 0
