0 mol 0 unq 0 iso 0 dist 9.94618 9.83355 19.2476 7.16396 16.0152 6.64713 numMergedOcc 0
1 mol 30 unq 0 iso 0 dist 9.32305 7.96082 5.29515 11.9275 10.4587 6.55815 numMergedOcc 0
2 mol 30 unq 1 iso 0 dist 9.32305 7.96082 5.29515 9.79457 12.3189 7.09121 numMergedOcc 0
3 mol 52 unq 0 iso 0 dist 9.67023 8.76527 5.53213 15.5426 15.0127 9.80143 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 7.53504 8.0534 10.565 14.9324 14.2184 7.62738 numMergedOcc 0
5 mol 73 unq 1 iso 0 dist 8.66342 8.0534 10.0209 14.9324 12.4862 7.62738 numMergedOcc 0
6 mol 73 unq 2 iso 0 dist 7.21285 8.0534 6.28525 14.9324 9.53327 7.62738 numMergedOcc 0
7 mol 73 unq 3 iso 0 dist 6.95094 8.0534 5.32605 14.9324 11.5958 7.62738 numMergedOcc 0
8 mol 75 unq 0 iso 0 dist 8.47302 5.50645 7.01551 5.78327 12.7098 7.6433 numMergedOcc 0
9 mol 79 unq 0 iso 0 dist 8.99379 8.79186 6.22712 5.71329 10.9594 9.36156 numMergedOcc 0
10 mol 108 unq 0 iso 0 dist 7.58484 7.61275 3.73122 5.83671 8.06774 6.12967 numMergedOcc 0
11 mol 114 unq 0 iso 0 dist 8.592 6.07991 10.9798 14.3305 19.5327 9.35942 numMergedOcc 0
12 mol 126 unq 0 iso 0 dist 9.40608 9.31118 12.3511 5.23583 12.4696 5.94233 numMergedOcc 0
13 mol 126 unq 1 iso 0 dist 9.40608 9.31118 12.3511 11.0459 16.2098 8.56219 numMergedOcc 0
14 mol 152 unq 0 iso 0 dist 7.99446 7.27943 10.149 5.8155 9.62138 5.06613 numMergedOcc 0
15 mol 152 unq 1 iso 0 dist 7.21636 7.27943 5.77969 5.8155 5.11444 5.06613 numMergedOcc 0
16 mol 186 unq 0 iso 0 dist 8.09373 5.31166 8.13761 9.11826 15.0225 7.46987 numMergedOcc 0
17 mol 193 unq 0 iso 0 dist 5.19654 7.46207 7.98055 9.7127 13.4513 7.8141 numMergedOcc 0
18 mol 193 unq 1 iso 0 dist 5.19654 7.46207 7.98055 10.7013 8.95886 8.43187 numMergedOcc 0
19 mol 203 unq 0 iso 0 dist 8.8589 6.97422 10.6706 5.39235 13.735 7.94843 numMergedOcc 0
20 mol 209 unq 0 iso 0 dist 8.65539 9.93982 11.3106 5.78532 13.01 7.97418 numMergedOcc 0
21 mol 209 unq 1 iso 0 dist 7.757 9.9518 9.44664 5.54278 11.0803 7.97418 numMergedOcc 0
22 mol 220 unq 0 iso 0 dist 7.0166 9.61475 9.38497 5.5411 11.8477 9.72138 numMergedOcc 0
23 mol 220 unq 1 iso 0 dist 8.75468 9.61475 12.2857 5.5411 11.6099 9.72138 numMergedOcc 0
24 mol 220 unq 2 iso 0 dist 8.60479 9.68034 12.2857 4.86867 11.6099 9.72138 numMergedOcc 0
25 mol 220 unq 3 iso 0 dist 7.96032 8.1579 5.96592 8.80812 13.8922 9.72138 numMergedOcc 0
26 mol 234 unq 0 iso 0 dist 8.8978 9.2457 4.7189 6.2709 5.68253 6.00582 numMergedOcc 0
27 mol 277 unq 0 iso 0 dist 7.98871 9.06496 7.01469 10.0166 13.4835 7.85414 numMergedOcc 0
28 mol 279 unq 0 iso 0 dist 7.88102 7.84195 15.0876 13.3542 19.8664 9.30921 numMergedOcc 0
29 mol 279 unq 1 iso 0 dist 7.93694 7.84195 13.7974 13.3542 20.6158 9.30921 numMergedOcc 0
