0 mol 20 unq 0 iso 0 dist 6.90375 6.75769 9.84521 6.18227 4.5008 6.18007 numMergedOcc 0
1 mol 32 unq 0 iso 0 dist 8.70934 3.24351 5.9972 8.5448 6.00133 5.78231 numMergedOcc 0
2 mol 32 unq 1 iso 0 dist 8.70934 3.24351 5.9972 10.8455 5.43575 9.41538 numMergedOcc 0
3 mol 34 unq 0 iso 0 dist 8.23162 4.61111 8.61815 7.77613 4.6013 7.68019 numMergedOcc 0
4 mol 90 unq 0 iso 0 dist 8.79724 11.6646 6.18681 16.1622 8.43244 6.02596 numMergedOcc 0
5 mol 90 unq 1 iso 0 dist 8.79724 11.6646 6.18681 17.0072 12.4268 8.17454 numMergedOcc 0
6 mol 141 unq 0 iso 0 dist 8.82363 10.39 6.40751 11.9108 4.41049 5.86693 numMergedOcc 0
7 mol 141 unq 1 iso 0 dist 5.76702 8.89934 6.40751 9.90615 4.41049 5.86693 numMergedOcc 0
8 mol 147 unq 0 iso 0 dist 7.88785 5.76262 9.23589 13.9453 12.1835 8.94352 numMergedOcc 0
9 mol 176 unq 0 iso 0 dist 6.47176 5.25264 9.67312 9.50494 9.87769 8.00223 numMergedOcc 0
10 mol 176 unq 1 iso 0 dist 8.92131 3.97245 9.67312 11.1439 9.87769 8.00223 numMergedOcc 0
11 mol 212 unq 0 iso 0 dist 6.80916 5.15503 6.07371 10.018 6.91503 8.13391 numMergedOcc 0
12 mol 212 unq 1 iso 0 dist 6.80916 5.15503 6.07371 12.558 10.1859 9.10717 numMergedOcc 0
13 mol 212 unq 2 iso 0 dist 6.80916 4.15106 7.98532 10.018 6.91503 8.4285 numMergedOcc 0
14 mol 239 unq 0 iso 0 dist 9.33636 8.28284 6.16848 5.00508 7.2107 5.79883 numMergedOcc 0
15 mol 239 unq 1 iso 0 dist 7.22539 12.6564 6.16848 10.4379 7.2107 5.79883 numMergedOcc 0
16 mol 264 unq 0 iso 0 dist 6.61098 11.3526 8.56867 16.3282 10.9568 9.05879 numMergedOcc 0
17 mol 264 unq 1 iso 0 dist 6.61098 11.3526 8.56867 6.14231 6.08436 6.67548 numMergedOcc 0
18 mol 264 unq 2 iso 0 dist 6.61098 8.93485 6.29872 6.14231 6.08436 5.57579 numMergedOcc 0
19 mol 264 unq 3 iso 0 dist 6.25794 6.26054 8.56867 13.4709 10.9568 9.05879 numMergedOcc 0
20 mol 264 unq 4 iso 0 dist 6.25794 6.26054 8.56867 4.68488 6.08436 6.67548 numMergedOcc 0
21 mol 264 unq 5 iso 0 dist 6.25794 3.81537 6.29872 4.68488 6.08436 5.57579 numMergedOcc 0
22 mol 287 unq 0 iso 0 dist 9.99897 9.53574 5.50067 16.8375 8.73374 9.14217 numMergedOcc 0
23 mol 288 unq 0 iso 0 dist 9.99897 9.53574 5.50067 16.8375 8.73374 9.14217 numMergedOcc 0
24 mol 289 unq 0 iso 0 dist 9.99897 9.53574 5.50067 16.8375 8.73374 9.14217 numMergedOcc 0
