0 mol 67 unq 0 iso 0 dist 9.46659 4.89257 9.8048 11.0848 5.49536 9.43192 numMergedOcc 0
1 mol 67 unq 1 iso 0 dist 8.44837 10.4826 9.8048 13.0767 5.49536 9.43192 numMergedOcc 0
2 mol 96 unq 0 iso 0 dist 9.25716 5.98026 8.71026 6.64899 7.7528 8.40684 numMergedOcc 0
3 mol 96 unq 1 iso 0 dist 6.29224 7.13132 8.71026 8.02307 7.7528 8.40684 numMergedOcc 0
4 mol 100 unq 0 iso 0 dist 5.72842 6.69867 8.09751 10.538 5.85333 8.96628 numMergedOcc 0
5 mol 103 unq 0 iso 0 dist 7.4348 13.5908 8.88401 16.7849 11.3296 9.42064 numMergedOcc 0
6 mol 125 unq 0 iso 0 dist 9.22891 9.99719 8.44933 7.69802 6.57549 9.5205 numMergedOcc 0
7 mol 125 unq 1 iso 0 dist 9.22891 5.34174 7.43803 7.69802 6.57549 7.1608 numMergedOcc 0
8 mol 140 unq 0 iso 0 dist 9.68237 6.59641 6.55217 13.3667 6.09043 9.16949 numMergedOcc 0
9 mol 140 unq 1 iso 0 dist 9.68237 5.40927 7.21686 13.3667 6.09043 8.65294 numMergedOcc 0
10 mol 154 unq 0 iso 0 dist 7.16289 6.40531 4.62366 12.0508 7.37385 6.17381 numMergedOcc 0
11 mol 154 unq 1 iso 0 dist 9.3164 13.1055 4.62366 16.5036 7.37385 6.17381 numMergedOcc 0
12 mol 171 unq 0 iso 0 dist 8.63202 6.94063 4.59484 11.9989 5.07414 9.23587 numMergedOcc 0
13 mol 171 unq 1 iso 0 dist 4.46397 4.53761 4.59484 9.21132 5.07414 9.23587 numMergedOcc 0
14 mol 226 unq 0 iso 0 dist 7.58016 5.48857 6.19519 13.6123 11.2053 8.29033 numMergedOcc 0
15 mol 226 unq 1 iso 0 dist 7.58016 5.48857 6.19519 10.527 6.81662 5.44698 numMergedOcc 0
16 mol 239 unq 0 iso 0 dist 6.84692 7.26324 8.92121 5.00508 4.30527 9.19442 numMergedOcc 0
17 mol 241 unq 0 iso 0 dist 8.0779 5.88645 6.54678 5.65753 5.67278 5.42605 numMergedOcc 0
18 mol 287 unq 0 iso 0 dist 6.75269 9.62966 8.44356 10.711 5.63549 5.92999 numMergedOcc 0
19 mol 287 unq 1 iso 0 dist 6.75269 9.62966 8.44356 8.62338 6.76834 4.75392 numMergedOcc 0
20 mol 288 unq 0 iso 0 dist 6.75269 9.62966 8.44356 10.711 5.63549 5.92999 numMergedOcc 0
21 mol 288 unq 1 iso 0 dist 6.75269 9.62966 8.44356 8.62338 6.76834 4.75392 numMergedOcc 0
22 mol 289 unq 0 iso 0 dist 6.75269 9.62966 8.44356 10.711 5.63549 5.92999 numMergedOcc 0
23 mol 289 unq 1 iso 0 dist 6.75269 9.62966 8.44356 8.62338 6.76834 4.75392 numMergedOcc 0
24 mol 294 unq 0 iso 0 dist 9.83069 6.49126 8.46311 9.03579 11.0408 5.25409 numMergedOcc 0
