0 mol 10 unq 0 iso 0 dist 9.09758 7.18129 8.44864 6.55806 5.59965 5.94361 6.72359 7.8329 10.0703 9.76721 numMergedOcc 0
1 mol 11 unq 0 iso 0 dist 7.05626 5.9304 9.78754 10.0977 7.98326 9.66474 12.3213 9.81983 9.26728 6.76736 numMergedOcc 0
2 mol 11 unq 1 iso 0 dist 7.05626 5.9304 9.78754 6.5069 7.90478 10.3999 12.3213 9.81983 9.26728 13.5186 numMergedOcc 0
3 mol 26 unq 0 iso 0 dist 8.01238 10.3572 9.44507 13.0316 6.56527 14.288 11.3323 9.11311 3.30063 12.5394 numMergedOcc 0
4 mol 54 unq 0 iso 0 dist 6.54052 10.5752 4.38047 11.754 9.17082 10.5895 11.8083 5.27979 2.97898 10.1434 numMergedOcc 0
5 mol 55 unq 0 iso 0 dist 9.3341 4.19247 6.66861 14.1948 9.93096 10.042 10.9631 6.76315 6.77823 3.56023 numMergedOcc 0
6 mol 55 unq 1 iso 0 dist 9.3341 6.83997 6.72084 14.1948 9.93096 12.1572 10.9631 6.76315 8.80267 3.56023 numMergedOcc 0
7 mol 91 unq 0 iso 0 dist 7.42828 4.23238 5.51406 9.18905 8.66165 10.4949 6.21311 9.97813 8.88997 5.21888 numMergedOcc 0
8 mol 91 unq 1 iso 0 dist 5.98441 6.31416 5.51406 8.00102 8.66165 10.4949 7.17072 9.97813 8.88997 5.21888 numMergedOcc 0
9 mol 91 unq 2 iso 0 dist 5.45873 4.23182 5.51406 11.1564 8.66165 10.4949 10.0233 9.97813 8.88997 5.21888 numMergedOcc 0
10 mol 93 unq 0 iso 0 dist 6.58492 10.7482 7.4518 4.41856 8.89417 14.4094 8.25205 7.83506 14.6061 5.90646 numMergedOcc 0
11 mol 93 unq 1 iso 0 dist 6.58492 10.7482 7.4518 5.93923 9.95255 9.73718 8.25205 7.83506 14.6061 12.949 numMergedOcc 0
12 mol 93 unq 2 iso 0 dist 7.63783 14.6717 7.4518 4.39585 8.89417 14.4094 3.27874 7.83506 14.6061 5.90646 numMergedOcc 0
13 mol 93 unq 3 iso 0 dist 7.63783 14.6717 7.4518 12.2294 9.95255 9.73718 3.27874 7.83506 14.6061 12.949 numMergedOcc 0
14 mol 113 unq 0 iso 0 dist 9.17878 18.003 9.66068 3.87164 6.6317 14.6132 16.4052 7.40338 3.74516 13.2601 numMergedOcc 0
15 mol 244 unq 0 iso 0 dist 9.28249 15.1414 8.08939 15.877 7.95359 8.89726 15.678 9.30179 15.1141 8.74744 numMergedOcc 0
16 mol 244 unq 1 iso 0 dist 9.28249 15.1414 8.08939 15.877 7.95359 8.89726 14.6968 6.10489 3.62882 5.98501 numMergedOcc 0
17 mol 244 unq 2 iso 0 dist 9.28249 15.1414 8.08939 15.877 7.95359 8.89726 11.0278 4.4204 7.8506 5.00596 numMergedOcc 0
18 mol 244 unq 3 iso 0 dist 9.28249 15.1414 8.08939 6.12937 6.22122 10.6799 15.678 9.30179 15.1141 13.2473 numMergedOcc 0
19 mol 244 unq 4 iso 0 dist 9.28249 15.1414 8.08939 6.12937 6.22122 10.6799 14.6968 6.10489 3.62882 10.1665 numMergedOcc 0
20 mol 244 unq 5 iso 0 dist 9.28249 15.1414 8.08939 6.12937 6.22122 10.6799 11.0278 4.4204 7.8506 5.68434 numMergedOcc 0
21 mol 244 unq 6 iso 0 dist 9.28249 13.9103 7.33574 15.877 7.95359 4.55034 15.678 9.30179 12.1511 8.74744 numMergedOcc 0
22 mol 244 unq 7 iso 0 dist 9.28249 13.9103 7.33574 15.877 7.95359 4.55034 14.6968 6.10489 5.2503 5.98501 numMergedOcc 0
23 mol 244 unq 8 iso 0 dist 9.28249 13.9103 7.33574 15.877 7.95359 4.55034 11.0278 4.4204 3.66626 5.00596 numMergedOcc 0
24 mol 244 unq 9 iso 0 dist 9.28249 13.9103 7.33574 6.12937 6.22122 8.05133 15.678 9.30179 12.1511 13.2473 numMergedOcc 0
25 mol 244 unq 10 iso 0 dist 9.28249 13.9103 7.33574 6.12937 6.22122 8.05133 14.6968 6.10489 5.2503 10.1665 numMergedOcc 0
26 mol 244 unq 11 iso 0 dist 9.28249 13.9103 7.33574 6.12937 6.22122 8.05133 11.0278 4.4204 3.66626 5.68434 numMergedOcc 0
27 mol 249 unq 0 iso 0 dist 6.7282 12.0518 6.58109 7.64577 5.9627 6.02223 3.89698 8.76518 14.8497 11.2713 numMergedOcc 0
28 mol 260 unq 0 iso 0 dist 8.75324 9.65309 5.68717 6.49889 9.32954 7.55193 7.27279 6.49413 3.48905 4.07425 numMergedOcc 0
29 mol 260 unq 1 iso 0 dist 8.75324 9.65309 5.68717 6.49889 9.32954 7.55193 9.87974 6.12343 3.43711 9.82931 numMergedOcc 0
30 mol 260 unq 2 iso 0 dist 8.75324 9.65309 5.68717 6.49889 9.32954 7.55193 5.97575 4.52405 8.84611 9.36278 numMergedOcc 0
