0 mol 7 unq 0 iso 0 dist 9.8603 14.6665 7.10621 12.5174 6.09254 7.21217 16.2118 7.12508 6.1206 5.07985 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 9.8603 14.6665 7.10621 12.5174 6.09254 7.21217 18.9985 11.143 7.67927 6.83196 numMergedOcc 0
2 mol 16 unq 0 iso 0 dist 6.36377 5.48395 6.31718 9.56648 5.35079 5.84479 9.8871 4.65873 8.43054 6.04677 numMergedOcc 0
3 mol 59 unq 0 iso 0 dist 7.7978 6.8958 7.17396 5.70814 6.34264 6.48625 11.5355 7.31539 6.56212 11.1377 numMergedOcc 0
4 mol 59 unq 1 iso 0 dist 9.55751 5.85228 7.17396 5.58384 6.34264 6.48625 11.9689 7.31539 6.56212 11.1377 numMergedOcc 0
5 mol 109 unq 0 iso 0 dist 8.73648 9.47324 7.34473 7.66832 5.5332 8.21889 13.543 6.73011 6.29161 10.4255 numMergedOcc 0
6 mol 109 unq 1 iso 0 dist 8.73648 9.47324 7.34473 7.66832 5.5332 8.21889 17.3399 13.0886 7.86666 14.5244 numMergedOcc 0
7 mol 117 unq 0 iso 0 dist 6.90827 10.4485 7.90328 18.0633 14.3476 7.70533 15.0886 10.5783 6.10127 6.66127 numMergedOcc 0
8 mol 117 unq 1 iso 0 dist 8.90977 13.8755 7.90328 20.747 14.3476 7.70533 18.6425 10.5783 6.10127 6.66127 numMergedOcc 0
9 mol 152 unq 0 iso 0 dist 8.07256 10.4039 8.56324 16.9685 13.2491 8.89982 12.0918 5.39112 6.59889 9.0696 numMergedOcc 0
10 mol 152 unq 1 iso 0 dist 8.07256 10.4039 8.56324 16.9685 13.2491 8.89982 11.756 4.84714 8.9192 9.83062 numMergedOcc 0
11 mol 205 unq 0 iso 0 dist 6.752 4.2475 7.45763 10.7582 10.6123 8.43584 6.41148 8.67921 6.49765 14.6356 numMergedOcc 0
12 mol 205 unq 1 iso 0 dist 5.4913 6.8901 7.45763 13.5379 10.6123 8.43584 5.06713 8.67921 6.49765 14.6356 numMergedOcc 0
13 mol 224 unq 0 iso 0 dist 8.39002 5.72088 6.57273 13.2856 5.63485 9.79616 6.32334 7.05804 8.79428 12.65 numMergedOcc 0
14 mol 224 unq 1 iso 0 dist 8.39002 6.51315 5.78342 12.9091 4.8786 9.29703 6.32334 7.05804 6.8692 9.56183 numMergedOcc 0
15 mol 224 unq 2 iso 0 dist 8.46129 5.72088 6.60589 13.2856 9.36962 9.79616 6.32334 5.76843 8.79428 12.65 numMergedOcc 0
16 mol 224 unq 3 iso 0 dist 8.46129 6.51315 9.16166 12.9091 7.18448 9.29703 6.32334 5.76843 6.8692 9.56183 numMergedOcc 0
17 mol 224 unq 4 iso 0 dist 9.2053 6.51315 5.81334 12.9091 6.38066 9.29703 6.32334 4.54188 6.8692 9.56183 numMergedOcc 0
18 mol 236 unq 0 iso 0 dist 9.05929 4.32403 8.04248 12.3123 6.0258 9.10613 10.5185 4.66414 8.23087 4.8226 numMergedOcc 0
19 mol 238 unq 0 iso 0 dist 9.94315 12.521 5.72887 15.9247 6.62361 9.31417 7.13727 7.06793 9.72188 13.338 numMergedOcc 0
20 mol 238 unq 1 iso 0 dist 9.94315 12.521 5.72887 15.6563 5.96552 5.56719 7.13727 7.06793 9.72188 12.046 numMergedOcc 0
21 mol 238 unq 2 iso 0 dist 8.59074 9.18011 5.72887 14.2562 6.62361 9.31417 8.56975 7.06793 9.72188 13.338 numMergedOcc 0
22 mol 238 unq 3 iso 0 dist 8.59074 9.18011 5.72887 13.2039 5.96552 5.56719 8.56975 7.06793 9.72188 12.046 numMergedOcc 0
23 mol 238 unq 4 iso 0 dist 6.2365 4.7157 5.72887 9.91921 6.62361 9.31417 10.5721 7.06793 9.72188 13.338 numMergedOcc 0
24 mol 238 unq 5 iso 0 dist 6.2365 4.7157 5.72887 8.20243 5.96552 5.56719 10.5721 7.06793 9.72188 12.046 numMergedOcc 0
25 mol 259 unq 0 iso 0 dist 8.06771 6.64729 8.13497 5.98006 5.71237 6.77279 13.9131 8.8603 9.07743 9.90573 numMergedOcc 0
26 mol 259 unq 1 iso 0 dist 8.06771 9.79538 7.88519 5.98006 5.71237 9.58006 14.2921 7.20604 9.63573 12.7528 numMergedOcc 0
27 mol 259 unq 2 iso 0 dist 8.06771 9.79538 7.88519 5.98006 5.71237 9.58006 13.9131 8.8603 7.66153 9.90573 numMergedOcc 0
28 mol 259 unq 3 iso 0 dist 9.54857 15.3806 7.46176 17.6082 11.8501 9.58006 13.6312 5.21606 9.63573 12.7528 numMergedOcc 0
29 mol 259 unq 4 iso 0 dist 9.54857 15.3806 7.46176 17.6082 11.8501 9.58006 21.0823 11.8896 7.66153 9.90573 numMergedOcc 0
