0 mol 7 unq 0 iso 0 dist 9.60361 12.1978 9.67164 13.4908 5.5683 8.72114 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 9.60361 4.78012 5.99459 7.13214 6.12483 5.99972 numMergedOcc 0
2 mol 25 unq 0 iso 0 dist 6.04822 6.32132 7.52933 13.096 11.0227 7.45383 numMergedOcc 0
3 mol 25 unq 1 iso 0 dist 6.04822 6.32132 7.52933 12.7595 15.1255 9.01548 numMergedOcc 0
4 mol 25 unq 2 iso 0 dist 7.72717 6.32132 8.23761 13.096 11.7069 7.45383 numMergedOcc 0
5 mol 25 unq 3 iso 0 dist 7.72717 6.32132 8.23761 12.7595 13.1117 9.01548 numMergedOcc 0
6 mol 56 unq 0 iso 0 dist 8.65122 14.1823 9.03564 15.7235 9.76482 7.16773 numMergedOcc 0
7 mol 59 unq 0 iso 0 dist 5.73075 7.35881 6.56212 10.0261 5.56986 8.08618 numMergedOcc 0
8 mol 60 unq 0 iso 0 dist 8.93538 8.71681 8.4312 12.3408 5.85676 9.90939 numMergedOcc 0
9 mol 68 unq 0 iso 0 dist 4.88863 5.19333 6.17207 8.14607 3.85627 7.26024 numMergedOcc 0
10 mol 68 unq 1 iso 0 dist 4.88863 5.19333 6.17207 9.79992 7.15683 6.36086 numMergedOcc 0
11 mol 68 unq 2 iso 0 dist 8.2282 5.57159 6.17207 7.38868 3.85627 7.26024 numMergedOcc 0
12 mol 68 unq 3 iso 0 dist 8.2282 5.57159 6.17207 9.04129 7.15683 6.36086 numMergedOcc 0
13 mol 69 unq 0 iso 0 dist 5.89383 7.05285 6.9362 10.282 5.1678 9.97775 numMergedOcc 0
14 mol 98 unq 0 iso 0 dist 9.91835 7.57533 9.64383 14.5387 12.82 7.23884 numMergedOcc 0
15 mol 98 unq 1 iso 0 dist 9.91835 11.7846 7.54889 11.2805 3.92737 4.47349 numMergedOcc 0
16 mol 98 unq 2 iso 0 dist 9.91835 15.0999 7.78931 11.2805 3.92737 5.65185 numMergedOcc 0
17 mol 98 unq 3 iso 0 dist 9.29692 10.9992 5.10496 12.4011 3.94967 6.7117 numMergedOcc 0
18 mol 98 unq 4 iso 0 dist 9.29692 14.2079 5.2571 12.4011 3.94967 4.47349 numMergedOcc 0
19 mol 98 unq 5 iso 0 dist 9.29692 17.8653 8.7497 12.4011 3.94967 5.65185 numMergedOcc 0
20 mol 98 unq 6 iso 0 dist 7.6935 9.00814 9.64383 14.2553 12.82 7.23884 numMergedOcc 0
21 mol 98 unq 7 iso 0 dist 7.6935 5.65902 7.54889 7.43804 3.92737 4.47349 numMergedOcc 0
22 mol 98 unq 8 iso 0 dist 7.6935 7.85074 7.78931 7.43804 3.92737 5.65185 numMergedOcc 0
23 mol 98 unq 9 iso 0 dist 8.71558 13.2064 5.10496 7.43804 3.94967 6.7117 numMergedOcc 0
24 mol 98 unq 10 iso 0 dist 8.71558 5.65902 5.2571 7.43804 3.94967 4.47349 numMergedOcc 0
25 mol 98 unq 11 iso 0 dist 8.71558 7.85074 8.7497 7.43804 3.94967 5.65185 numMergedOcc 0
26 mol 119 unq 0 iso 0 dist 9.9292 14.5985 8.95212 19.6676 12.3661 8.00003 numMergedOcc 0
27 mol 119 unq 1 iso 0 dist 9.9292 6.92096 6.99446 14.3225 5.37917 9.11344 numMergedOcc 0
28 mol 119 unq 2 iso 0 dist 9.9292 11.7253 7.64052 14.3225 5.37917 6.52773 numMergedOcc 0
29 mol 119 unq 3 iso 0 dist 9.9292 11.7253 7.64052 19.1958 15.7711 9.23858 numMergedOcc 0
30 mol 167 unq 0 iso 0 dist 5.57495 5.89138 7.20495 7.93807 5.43662 9.67741 numMergedOcc 0
31 mol 167 unq 1 iso 0 dist 9.38297 5.89138 7.02548 7.93807 5.95858 9.67741 numMergedOcc 0
32 mol 222 unq 0 iso 0 dist 7.17095 5.15194 6.74196 11.2537 4.67663 9.07471 numMergedOcc 0
33 mol 279 unq 0 iso 0 dist 6.63442 5.65983 7.24366 7.37358 4.05042 7.23721 numMergedOcc 0
34 mol 287 unq 0 iso 0 dist 7.74312 6.56751 7.45616 9.52718 5.97664 9.65934 numMergedOcc 0
35 mol 288 unq 0 iso 0 dist 7.74312 6.56751 7.45616 9.52718 5.97664 9.65934 numMergedOcc 0
36 mol 289 unq 0 iso 0 dist 7.74312 6.56751 7.45616 9.52718 5.97664 9.65934 numMergedOcc 0
37 mol 292 unq 0 iso 0 dist 7.18462 9.32514 9.46442 10.7309 6.00981 8.87028 numMergedOcc 0
38 mol 292 unq 1 iso 0 dist 6.66342 12.1831 9.9182 17.0544 13.4805 7.83341 numMergedOcc 0
39 mol 292 unq 2 iso 0 dist 6.66342 9.32514 7.30758 10.7309 4.09485 8.87028 numMergedOcc 0
