0 mol 24 unq 0 iso 0 dist 6.11056 8.94703 4.79736 8.95357 8.20058 8.45916 10.4744 8.86116 12.3058 16.6906 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 6.11056 8.94703 4.79736 8.95357 8.20058 8.45916 6.9756 8.38394 10.6772 14.9411 numMergedOcc 0
2 mol 25 unq 0 iso 0 dist 8.88413 8.27137 11.4148 5.30126 6.22122 9.55662 5.59268 7.17969 4.79873 4.96681 numMergedOcc 0
3 mol 26 unq 0 iso 0 dist 6.88695 9.63803 8.25132 4.54484 7.51406 12.4917 5.3315 8.34347 13.6027 6.4487 numMergedOcc 0
4 mol 56 unq 0 iso 0 dist 7.20538 7.93171 9.96534 8.39913 8.96238 15.7801 6.93876 8.66265 13.2483 7.43826 numMergedOcc 0
5 mol 98 unq 0 iso 0 dist 5.9747 8.3505 3.9764 11.1108 8.05602 9.55337 4.75138 5.08437 5.10496 12.0507 numMergedOcc 0
6 mol 98 unq 1 iso 0 dist 5.9747 8.3505 3.9764 11.1108 8.05602 9.55337 10.4417 6.48948 5.92242 4.72129 numMergedOcc 0
7 mol 98 unq 2 iso 0 dist 5.9747 8.3505 3.9764 11.1108 8.05602 9.55337 11.3628 6.10456 5.2571 12.0339 numMergedOcc 0
8 mol 98 unq 3 iso 0 dist 5.9747 7.34638 7.03983 11.1108 8.05602 4.79891 4.75138 5.08437 9.89095 12.0507 numMergedOcc 0
9 mol 98 unq 4 iso 0 dist 5.9747 7.34638 7.03983 11.1108 8.05602 4.79891 10.4417 6.48948 7.02507 4.72129 numMergedOcc 0
10 mol 98 unq 5 iso 0 dist 5.9747 7.34638 7.03983 11.1108 8.05602 4.79891 11.3628 6.10456 12.7417 12.0339 numMergedOcc 0
11 mol 98 unq 6 iso 0 dist 4.50572 6.0995 7.03983 9.17639 8.05602 4.79891 6.88489 5.08437 9.89095 12.0507 numMergedOcc 0
12 mol 98 unq 7 iso 0 dist 4.50572 6.0995 7.03983 9.17639 8.05602 4.79891 9.63267 6.48948 7.02507 4.72129 numMergedOcc 0
13 mol 98 unq 8 iso 0 dist 4.50572 6.0995 7.03983 9.17639 8.05602 4.79891 9.82583 6.10456 12.7417 12.0339 numMergedOcc 0
14 mol 98 unq 9 iso 0 dist 4.50572 9.25525 13.1657 9.17639 8.05602 12.3562 6.88489 5.08437 15.844 12.0507 numMergedOcc 0
15 mol 98 unq 10 iso 0 dist 4.50572 9.25525 13.1657 9.17639 8.05602 12.3562 9.63267 6.48948 15.731 4.72129 numMergedOcc 0
16 mol 98 unq 11 iso 0 dist 4.50572 9.25525 13.1657 9.17639 8.05602 12.3562 9.82583 6.10456 18.1227 12.0339 numMergedOcc 0
17 mol 109 unq 0 iso 0 dist 8.3164 9.94704 5.00433 7.12319 8.84523 13.0202 11.5656 8.69985 8.52024 14.7654 numMergedOcc 0
18 mol 109 unq 1 iso 0 dist 8.3164 8.30089 6.35679 7.12319 8.84523 7.22752 11.5656 8.69985 14.6042 14.7654 numMergedOcc 0
19 mol 119 unq 0 iso 0 dist 5.63005 9.10803 8.84069 11.5865 8.62648 14.5947 10.5268 8.73993 16.2889 4.6251 numMergedOcc 0
20 mol 129 unq 0 iso 0 dist 6.38163 6.53559 6.28232 8.56696 6.23966 8.46972 8.61575 9.61051 11.3039 5.16275 numMergedOcc 0
21 mol 129 unq 1 iso 0 dist 6.38163 6.53559 6.28232 8.56696 6.23966 8.46972 10.0961 5.83384 11.7541 6.65856 numMergedOcc 0
22 mol 129 unq 2 iso 0 dist 6.38163 7.90844 12.3705 8.56696 6.23966 15.9447 8.61575 9.61051 16.2082 5.16275 numMergedOcc 0
23 mol 129 unq 3 iso 0 dist 6.38163 7.90844 12.3705 8.56696 6.23966 15.9447 10.0961 5.83384 17.1791 6.65856 numMergedOcc 0
24 mol 224 unq 0 iso 0 dist 8.39002 6.32334 7.05804 4.61429 9.73411 5.31916 9.98893 8.95269 13.2325 14.1073 numMergedOcc 0
25 mol 224 unq 1 iso 0 dist 8.39002 6.32334 7.05804 4.61429 9.73411 5.31916 5.72088 6.57273 8.79428 9.81806 numMergedOcc 0
26 mol 224 unq 2 iso 0 dist 8.39002 6.32334 7.05804 4.61429 9.73411 5.31916 6.51315 5.78342 6.8692 5.99647 numMergedOcc 0
27 mol 224 unq 3 iso 0 dist 8.39002 6.32334 7.05804 11.1139 7.07564 11.6723 9.98893 8.95269 13.2325 11.8217 numMergedOcc 0
28 mol 224 unq 4 iso 0 dist 8.39002 6.32334 7.05804 11.1139 7.07564 11.6723 5.72088 6.57273 8.79428 10.8463 numMergedOcc 0
29 mol 224 unq 5 iso 0 dist 8.39002 6.32334 7.05804 11.1139 7.07564 11.6723 6.51315 5.78342 6.8692 5.44863 numMergedOcc 0
30 mol 224 unq 6 iso 0 dist 9.2053 6.32334 4.54188 4.61429 7.75485 5.31916 6.51315 5.81334 6.8692 5.99647 numMergedOcc 0
31 mol 224 unq 7 iso 0 dist 9.2053 6.32334 4.54188 11.1139 9.11052 11.6723 6.51315 5.81334 6.8692 5.44863 numMergedOcc 0
32 mol 238 unq 0 iso 0 dist 9.66555 6.96382 6.82305 5.12308 4.87108 5.41453 12.2428 6.22714 10.1172 7.45873 numMergedOcc 0
33 mol 238 unq 1 iso 0 dist 9.66555 6.96382 6.82305 9.76041 6.54455 10.6918 12.2428 6.22714 10.1172 5.17954 numMergedOcc 0
34 mol 259 unq 0 iso 0 dist 9.12507 4.95855 7.09907 8.46264 8.57619 10.5384 5.59901 5.30224 6.9899 5.43184 numMergedOcc 0
35 mol 259 unq 1 iso 0 dist 9.12507 7.72489 9.71793 8.46264 8.57619 14.0116 5.59901 5.30224 10.4017 5.43184 numMergedOcc 0
