0 mol 51 unq 0 iso 0 dist 7.7625 9.10817 7.12423 10.401 9.06397 10.8401 11.3631 5.27155 6.50216 7.95419 numMergedOcc 0
1 mol 112 unq 0 iso 0 dist 7.65229 6.50047 7.15985 11.4776 5.81552 9.87475 13.0796 9.60908 15.8105 9.42175 numMergedOcc 0
2 mol 167 unq 0 iso 0 dist 4.93984 6.87303 8.14096 4.72853 8.58946 11.1988 12.6803 13.1346 19.3396 9.82329 numMergedOcc 0
3 mol 167 unq 1 iso 0 dist 4.93984 6.01114 8.43038 4.72853 8.58946 5.44954 12.6803 13.1346 12.7444 9.82329 numMergedOcc 0
4 mol 167 unq 2 iso 0 dist 4.93984 9.04662 9.87966 4.72853 8.58946 9.15105 12.6803 13.1346 14.7796 9.82329 numMergedOcc 0
5 mol 210 unq 0 iso 0 dist 7.19917 11.8117 8.62103 7.45619 8.07523 14.9127 8.87835 5.82028 9.97171 6.24111 numMergedOcc 0
6 mol 210 unq 1 iso 0 dist 7.19917 11.8117 8.62103 7.45619 8.07523 14.9127 8.93859 4.62641 12.9116 8.60412 numMergedOcc 0
7 mol 210 unq 2 iso 0 dist 7.19917 11.8117 8.62103 4.70332 7.56882 14.823 8.87835 5.82028 9.97171 9.00343 numMergedOcc 0
8 mol 210 unq 3 iso 0 dist 7.19917 11.8117 8.62103 4.70332 7.56882 14.823 8.93859 4.62641 12.9116 7.05535 numMergedOcc 0
9 mol 218 unq 0 iso 0 dist 5.52981 7.26513 8.5119 6.43128 9.88212 5.55907 10.7321 9.38348 11.6122 9.86417 numMergedOcc 0
10 mol 241 unq 0 iso 0 dist 8.62971 8.34013 8.40773 7.14491 6.40592 4.84498 8.99792 4.86437 12.3126 9.174 numMergedOcc 0
11 mol 241 unq 1 iso 0 dist 8.62971 5.69491 9.18476 7.14491 6.40592 6.70277 8.99792 4.86437 8.15897 9.174 numMergedOcc 0
12 mol 253 unq 0 iso 0 dist 5.76077 5.03278 5.89502 11.6981 8.07341 9.90493 14.0812 11.4733 15.7064 9.58767 numMergedOcc 0
13 mol 253 unq 1 iso 0 dist 5.76077 4.58695 7.15815 11.6981 8.07341 14.7487 14.0812 11.4733 17.0634 9.58767 numMergedOcc 0
14 mol 253 unq 2 iso 0 dist 7.0247 12.6079 5.89502 12.0836 8.07341 9.90493 12.2223 11.4733 15.7064 9.58767 numMergedOcc 0
15 mol 253 unq 3 iso 0 dist 7.0247 11.088 7.15815 12.0836 8.07341 14.7487 12.2223 11.4733 17.0634 9.58767 numMergedOcc 0
16 mol 259 unq 0 iso 0 dist 6.49599 11.5386 8.06771 6.96133 6.96379 5.73217 10.3275 5.71237 5.98006 6.76656 numMergedOcc 0
17 mol 265 unq 0 iso 0 dist 4.96568 9.37522 9.772 11.7587 7.54805 9.91968 17.8101 15.4199 10.3071 9.56472 numMergedOcc 0
18 mol 265 unq 1 iso 0 dist 4.96568 9.37522 9.772 11.7587 7.54805 9.91968 16.7978 12.4903 14.648 6.5072 numMergedOcc 0
19 mol 265 unq 2 iso 0 dist 4.96568 9.37522 9.772 11.7587 7.54805 9.91968 9.97669 5.11366 11.5231 4.03921 numMergedOcc 0
20 mol 266 unq 0 iso 0 dist 9.27588 12.8888 8.59986 11.574 7.72749 6.31111 17.8125 10.2159 13.2523 9.58577 numMergedOcc 0
21 mol 272 unq 0 iso 0 dist 7.22438 7.51377 9.96394 10.4121 4.78812 12.1122 12.4008 5.96981 15.6437 7.50321 numMergedOcc 0
22 mol 272 unq 1 iso 0 dist 7.22438 7.51377 9.96394 10.4121 4.78812 12.1122 10.2183 6.76845 15.6477 9.61597 numMergedOcc 0
23 mol 279 unq 0 iso 0 dist 8.27977 4.0145 7.74162 8.89193 5.17586 6.05412 8.85653 6.03718 9.71653 8.57035 numMergedOcc 0
