0 mol 10 unq 0 iso 0 dist 9.09758 6.55806 5.59965 3.97711 9.43029 4.99208 6.72359 7.8329 9.76721 9.80612 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 8.01238 13.0316 6.56527 5.43726 6.7142 10.0347 11.3323 9.11311 12.5394 7.78809 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 8.58319 16.5457 8.29857 9.70093 6.03404 9.02536 9.02334 8.12997 12.4707 7.01802 numMergedOcc 0
3 mol 48 unq 1 iso 0 dist 8.58319 16.5457 8.29857 9.70093 6.03404 9.02536 10.5927 6.13153 8.98812 6.13982 numMergedOcc 0
4 mol 48 unq 2 iso 0 dist 8.58319 16.5457 8.29857 9.70093 6.03404 9.02536 13.7714 5.7836 3.50984 6.71583 numMergedOcc 0
5 mol 48 unq 3 iso 0 dist 8.58319 16.5457 8.29857 9.70093 6.03404 9.02536 8.34343 7.32996 11.7253 3.34853 numMergedOcc 0
6 mol 48 unq 4 iso 0 dist 8.58319 16.5457 8.29857 9.70093 6.03404 9.02536 4.67004 5.89173 12.69 5.12352 numMergedOcc 0
7 mol 48 unq 5 iso 0 dist 8.31952 16.2911 8.19993 9.69031 6.07052 9.12073 8.81271 7.84895 12.5401 7.14332 numMergedOcc 0
8 mol 48 unq 6 iso 0 dist 8.31952 16.2911 8.19993 9.69031 6.07052 9.12073 10.3594 5.8541 9.01489 6.15265 numMergedOcc 0
9 mol 48 unq 7 iso 0 dist 8.31952 16.2911 8.19993 9.69031 6.07052 9.12073 13.5251 5.82264 3.65036 6.77378 numMergedOcc 0
10 mol 48 unq 8 iso 0 dist 8.31952 16.2911 8.19993 9.69031 6.07052 9.12073 8.11968 7.20729 11.7978 3.3785 numMergedOcc 0
11 mol 48 unq 9 iso 0 dist 8.31952 16.2911 8.19993 9.69031 6.07052 9.12073 4.70736 5.72703 12.5721 5.14028 numMergedOcc 0
12 mol 55 unq 0 iso 0 dist 9.3341 14.1948 9.93096 9.27285 8.70598 10.7467 10.9631 6.76315 3.56023 8.04215 numMergedOcc 0
13 mol 79 unq 0 iso 0 dist 6.9297 12.6241 9.78384 3.89377 7.43127 9.51372 8.47393 6.86517 5.84075 5.9297 numMergedOcc 0
14 mol 91 unq 0 iso 0 dist 7.42828 9.18905 8.66165 8.88262 8.77355 10.6223 6.21311 9.97813 5.21888 9.60912 numMergedOcc 0
15 mol 91 unq 1 iso 0 dist 5.98441 8.00102 8.66165 11.1951 8.77355 10.6223 7.17072 9.97813 5.21888 9.60912 numMergedOcc 0
16 mol 91 unq 2 iso 0 dist 5.45873 11.1564 8.66165 10.5022 8.77355 10.6223 10.0233 9.97813 5.21888 9.60912 numMergedOcc 0
17 mol 93 unq 0 iso 0 dist 8.29506 4.41856 8.74378 8.09258 9.19977 11.7638 8.25205 5.56839 5.90646 13.1331 numMergedOcc 0
18 mol 93 unq 1 iso 0 dist 7.24843 4.39585 8.74378 13.069 9.19977 11.7638 3.27874 5.56839 5.90646 13.1331 numMergedOcc 0
19 mol 93 unq 2 iso 0 dist 6.58492 4.41856 8.89417 8.09258 7.28831 11.7638 8.25205 7.83506 5.90646 13.1331 numMergedOcc 0
20 mol 93 unq 3 iso 0 dist 6.58492 5.93923 9.95255 8.09258 7.28831 5.93472 8.25205 7.83506 12.949 13.1331 numMergedOcc 0
21 mol 93 unq 4 iso 0 dist 7.63783 4.39585 8.89417 13.069 7.28831 11.7638 3.27874 7.83506 5.90646 13.1331 numMergedOcc 0
22 mol 93 unq 5 iso 0 dist 7.63783 12.2294 9.95255 13.069 7.28831 5.93472 3.27874 7.83506 12.949 13.1331 numMergedOcc 0
23 mol 113 unq 0 iso 0 dist 9.17878 3.87164 6.6317 13.5478 9.30645 9.74974 16.4052 7.40338 13.2601 9.59189 numMergedOcc 0
24 mol 141 unq 0 iso 0 dist 6.41084 11.939 9.83945 10.6312 7.42144 16.2294 10.2696 4.92382 13.8739 5.83839 numMergedOcc 0
25 mol 141 unq 1 iso 0 dist 6.41084 11.939 9.83945 9.58584 6.27658 15.9806 10.2696 4.92382 13.8739 3.7404 numMergedOcc 0
26 mol 141 unq 2 iso 0 dist 6.93424 12.0582 6.75376 16.16 9.27009 6.93828 14.9967 8.40695 5.59893 3.37046 numMergedOcc 0
27 mol 141 unq 3 iso 0 dist 6.93424 12.0582 6.75376 16.16 9.27009 6.93828 14.2035 9.35867 3.89483 8.30017 numMergedOcc 0
28 mol 141 unq 4 iso 0 dist 6.8891 12.0582 9.10042 7.18009 6.65731 14.0725 14.2035 9.38036 3.89483 14.5559 numMergedOcc 0
29 mol 141 unq 5 iso 0 dist 6.8891 13.5187 9.75059 7.18009 6.65731 13.1981 14.2035 9.38036 4.1436 14.5559 numMergedOcc 0
30 mol 141 unq 6 iso 0 dist 6.8891 10.0354 6.83404 7.18009 6.65731 3.98068 14.2035 9.38036 12.6017 14.5559 numMergedOcc 0
31 mol 194 unq 0 iso 0 dist 7.71806 12.1101 6.1886 8.22995 4.19371 4.002 4.02402 8.43182 13.0087 9.23342 numMergedOcc 0
32 mol 194 unq 1 iso 0 dist 7.71806 12.1101 6.1886 12.3429 9.71015 7.09553 4.02402 8.43182 13.0087 11.7699 numMergedOcc 0
33 mol 244 unq 0 iso 0 dist 9.28249 15.877 7.95359 14.4096 6.53416 3.92686 15.678 9.30179 8.74744 4.99117 numMergedOcc 0
34 mol 244 unq 1 iso 0 dist 9.28249 15.877 7.95359 14.4096 6.53416 3.92686 14.6968 6.10489 5.98501 7.28456 numMergedOcc 0
35 mol 244 unq 2 iso 0 dist 9.28249 15.877 7.95359 14.4096 6.53416 3.92686 11.0278 4.4204 5.00596 5.39452 numMergedOcc 0
36 mol 244 unq 3 iso 0 dist 9.28249 6.12937 6.22122 14.4096 6.53416 10.3324 15.678 9.30179 13.2473 4.99117 numMergedOcc 0
37 mol 244 unq 4 iso 0 dist 9.28249 6.12937 6.22122 14.4096 6.53416 10.3324 14.6968 6.10489 10.1665 7.28456 numMergedOcc 0
38 mol 244 unq 5 iso 0 dist 9.28249 6.12937 6.22122 14.4096 6.53416 10.3324 11.0278 4.4204 5.68434 5.39452 numMergedOcc 0
39 mol 260 unq 0 iso 0 dist 8.75324 6.49889 9.32954 3.92288 6.75725 9.07649 7.27279 6.49413 4.07425 8.04546 numMergedOcc 0
40 mol 260 unq 1 iso 0 dist 8.75324 6.49889 9.32954 3.92288 6.75725 9.07649 9.87974 6.12343 9.82931 8.22506 numMergedOcc 0
41 mol 260 unq 2 iso 0 dist 8.75324 6.49889 9.32954 3.92288 6.75725 9.07649 5.97575 4.52405 9.36278 3.68866 numMergedOcc 0
42 mol 260 unq 3 iso 0 dist 8.75324 6.49889 9.32954 14.1341 9.31888 9.46408 7.27279 6.49413 4.07425 7.35802 numMergedOcc 0
43 mol 260 unq 4 iso 0 dist 8.75324 6.49889 9.32954 14.1341 9.31888 9.46408 9.87974 6.12343 9.82931 9.94995 numMergedOcc 0
44 mol 260 unq 5 iso 0 dist 8.75324 6.49889 9.32954 14.1341 9.31888 9.46408 5.97575 4.52405 9.36278 12.8784 numMergedOcc 0
