0 mol 10 unq 0 iso 0 dist 5.99743 8.98746 7.60549 4.75564 6.18431 6.77807 numMergedOcc 0
1 mol 28 unq 0 iso 0 dist 9.86409 5.75809 7.57437 6.51818 13.1714 9.2146 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 8.71284 7.07773 9.10687 8.03682 8.96684 7.34832 numMergedOcc 0
3 mol 39 unq 0 iso 0 dist 9.70029 8.82943 10.7337 7.71511 11.3405 8.68887 numMergedOcc 0
4 mol 79 unq 0 iso 0 dist 4.3247 4.5892 5.88927 10.8503 10.6064 9.21761 numMergedOcc 0
5 mol 116 unq 0 iso 0 dist 8.89769 6.82267 7.93893 15.5585 15.8754 9.87354 numMergedOcc 0
6 mol 186 unq 0 iso 0 dist 8.09667 7.62945 5.39534 9.55695 11.554 9.34653 numMergedOcc 0
7 mol 194 unq 0 iso 0 dist 9.819 7.26295 3.7326 11.023 4.19371 4.45769 numMergedOcc 0
8 mol 194 unq 1 iso 0 dist 9.819 7.26295 3.7326 12.3736 9.71015 8.99961 numMergedOcc 0
9 mol 194 unq 2 iso 0 dist 9.819 7.31316 7.29209 11.023 4.19371 5.89939 numMergedOcc 0
10 mol 194 unq 3 iso 0 dist 9.819 7.31316 7.29209 12.3736 9.71015 8.18853 numMergedOcc 0
11 mol 204 unq 0 iso 0 dist 6.62013 5.8294 6.52211 6.38603 12.8198 9.36334 numMergedOcc 0
12 mol 220 unq 0 iso 0 dist 8.06003 5.04072 8.44353 4.8189 12.4741 6.31365 numMergedOcc 0
13 mol 252 unq 0 iso 0 dist 9.1191 7.38867 3.99887 8.846 8.09509 9.81261 numMergedOcc 0
14 mol 279 unq 0 iso 0 dist 7.10052 7.72276 9.79726 4.1816 10.7197 7.90632 numMergedOcc 0
15 mol 285 unq 0 iso 0 dist 9.23037 8.38399 8.78384 13.1313 16.3628 7.73438 numMergedOcc 0
16 mol 287 unq 0 iso 0 dist 8.53802 9.2144 5.9468 9.11127 10.3645 8.06767 numMergedOcc 0
17 mol 287 unq 1 iso 0 dist 8.53802 9.2144 5.9468 18.3972 15.202 9.91087 numMergedOcc 0
18 mol 288 unq 0 iso 0 dist 8.53802 9.2144 5.9468 9.11127 10.3645 8.06767 numMergedOcc 0
19 mol 288 unq 1 iso 0 dist 8.53802 9.2144 5.9468 18.3972 15.202 9.91087 numMergedOcc 0
20 mol 289 unq 0 iso 0 dist 8.53802 9.2144 5.9468 9.11127 10.3645 8.06767 numMergedOcc 0
21 mol 289 unq 1 iso 0 dist 8.53802 9.2144 5.9468 18.3972 15.202 9.91087 numMergedOcc 0
