0 mol 64 unq 0 iso 0 dist 8.52643 7.59945 5.45684 9.75299 4.78627 7.66372 13.3239 7.76644 5.8441 9.99743 numMergedOcc 0
1 mol 64 unq 1 iso 0 dist 8.52643 13.3239 7.76644 9.75299 4.78627 9.99743 7.59945 5.45684 5.8441 7.66372 numMergedOcc 0
2 mol 64 unq 2 iso 0 dist 5.41357 5.65551 5.45684 9.30042 4.78627 7.66372 9.81422 7.76644 5.8441 9.99743 numMergedOcc 0
3 mol 64 unq 3 iso 0 dist 5.41357 9.81422 7.76644 9.30042 4.78627 9.99743 5.65551 5.45684 5.8441 7.66372 numMergedOcc 0
4 mol 64 unq 4 iso 0 dist 9.75299 7.59945 7.66372 8.52643 4.78627 5.45684 13.3239 9.99743 5.8441 7.76644 numMergedOcc 0
5 mol 64 unq 5 iso 0 dist 9.75299 13.3239 9.99743 8.52643 4.78627 7.76644 7.59945 7.66372 5.8441 5.45684 numMergedOcc 0
6 mol 64 unq 6 iso 0 dist 9.30042 5.65551 7.66372 5.41357 4.78627 5.45684 9.81422 9.99743 5.8441 7.76644 numMergedOcc 0
7 mol 64 unq 7 iso 0 dist 9.30042 9.81422 9.99743 5.41357 4.78627 7.76644 5.65551 7.66372 5.8441 5.45684 numMergedOcc 0
8 mol 73 unq 0 iso 0 dist 7.45777 10.345 6.85356 11.8571 4.56026 6.7939 18.2175 11.9229 12.5626 8.44695 numMergedOcc 0
9 mol 73 unq 1 iso 0 dist 7.45777 10.345 6.85356 11.8571 4.56026 6.7939 14.1204 7.32265 12.3241 5.68894 numMergedOcc 0
10 mol 73 unq 2 iso 0 dist 7.45777 14.1204 7.32265 11.8571 4.56026 5.68894 10.345 6.85356 12.3241 6.7939 numMergedOcc 0
11 mol 73 unq 3 iso 0 dist 7.45777 14.1204 7.32265 11.8571 4.56026 5.68894 18.2175 11.9229 9.3197 8.44695 numMergedOcc 0
12 mol 76 unq 0 iso 0 dist 8.7142 8.23824 5.37449 15.8537 7.53933 9.52666 16.2856 11.0609 8.15383 9.225 numMergedOcc 0
13 mol 99 unq 0 iso 0 dist 8.68674 8.61334 4.82346 16.0978 9.73996 9.39801 12.2155 8.07233 4.8794 6.02154 numMergedOcc 0
14 mol 99 unq 1 iso 0 dist 8.68674 12.2155 8.07233 16.0978 9.73996 6.02154 8.61334 4.82346 4.8794 9.39801 numMergedOcc 0
15 mol 220 unq 0 iso 0 dist 5.25149 8.17619 9.57625 8.6368 11.0459 8.08702 7.36665 12.5698 10.3111 9.984 numMergedOcc 0
16 mol 223 unq 0 iso 0 dist 6.97426 4.68566 7.96628 8.87456 4.71901 7.76053 11.1044 12.8908 7.55127 9.65728 numMergedOcc 0
17 mol 261 unq 0 iso 0 dist 7.58385 6.29331 8.25759 6.0437 5.29945 6.99444 6.8395 13.3884 10.4134 9.38192 numMergedOcc 0
18 mol 287 unq 0 iso 0 dist 5.15923 11.7624 9.30394 11.2356 8.60638 8.5458 5.58788 5.84467 6.60063 8.56533 numMergedOcc 0
19 mol 287 unq 1 iso 0 dist 5.15923 5.58788 5.84467 11.2356 8.60638 8.56533 11.7624 9.30394 6.60063 8.5458 numMergedOcc 0
20 mol 287 unq 2 iso 0 dist 7.14859 14.0575 8.5458 10.9141 8.60638 9.30394 10.6005 8.56533 6.60063 5.84467 numMergedOcc 0
21 mol 287 unq 3 iso 0 dist 7.14859 10.6005 8.56533 10.9141 8.60638 5.84467 14.0575 8.5458 6.60063 9.30394 numMergedOcc 0
22 mol 288 unq 0 iso 0 dist 5.15923 11.7624 9.30394 11.2356 8.60638 8.5458 5.58788 5.84467 6.60063 8.56533 numMergedOcc 0
23 mol 288 unq 1 iso 0 dist 5.15923 5.58788 5.84467 11.2356 8.60638 8.56533 11.7624 9.30394 6.60063 8.5458 numMergedOcc 0
24 mol 288 unq 2 iso 0 dist 7.14859 14.0575 8.5458 10.9141 8.60638 9.30394 10.6005 8.56533 6.60063 5.84467 numMergedOcc 0
25 mol 288 unq 3 iso 0 dist 7.14859 10.6005 8.56533 10.9141 8.60638 5.84467 14.0575 8.5458 6.60063 9.30394 numMergedOcc 0
26 mol 289 unq 0 iso 0 dist 5.15923 11.7624 9.30394 11.2356 8.60638 8.5458 5.58788 5.84467 6.60063 8.56533 numMergedOcc 0
27 mol 289 unq 1 iso 0 dist 5.15923 5.58788 5.84467 11.2356 8.60638 8.56533 11.7624 9.30394 6.60063 8.5458 numMergedOcc 0
28 mol 289 unq 2 iso 0 dist 7.14859 14.0575 8.5458 10.9141 8.60638 9.30394 10.6005 8.56533 6.60063 5.84467 numMergedOcc 0
29 mol 289 unq 3 iso 0 dist 7.14859 10.6005 8.56533 10.9141 8.60638 5.84467 14.0575 8.5458 6.60063 9.30394 numMergedOcc 0
