0 mol 19 unq 0 iso 0 dist 8.73972 6.36455 6.87842 5.03957 8.23643 6.92532 12.3215 14.4867 13.9675 7.75618 numMergedOcc 0
1 mol 19 unq 1 iso 0 dist 6.00439 7.48847 6.34272 7.83352 6.20943 10.1882 15.4288 11.4087 13.9675 8.40416 numMergedOcc 0
2 mol 19 unq 2 iso 0 dist 6.00439 7.48847 6.34272 10.8007 7.82528 6.92532 15.4288 11.4087 13.9675 7.75618 numMergedOcc 0
3 mol 19 unq 3 iso 0 dist 7.82528 6.92532 6.34272 7.67038 6.20943 10.1882 7.75618 11.4087 13.9675 8.40416 numMergedOcc 0
4 mol 26 unq 0 iso 0 dist 9.16962 5.69955 4.80984 13.2136 8.82012 10.4035 10.177 4.98603 5.30297 6.46104 numMergedOcc 0
5 mol 45 unq 0 iso 0 dist 7.06308 6.06454 5.94047 5.48601 9.43442 10.3991 10.862 8.70414 10.1895 9.53378 numMergedOcc 0
6 mol 45 unq 1 iso 0 dist 6.34173 9.44459 5.94047 5.101 9.43442 10.3991 10.6216 8.70414 10.1895 9.53378 numMergedOcc 0
7 mol 58 unq 0 iso 0 dist 6.46761 7.27383 9.17656 10.8153 8.63333 14.62 14.171 12.0055 12.6018 9.92355 numMergedOcc 0
8 mol 58 unq 1 iso 0 dist 6.46761 7.27383 9.17656 8.62958 8.89374 10.9864 14.171 12.0055 12.6018 7.68678 numMergedOcc 0
9 mol 109 unq 0 iso 0 dist 9.20981 7.55384 5.94311 4.98336 5.87358 5.34214 12.2341 6.89298 10.8469 7.80523 numMergedOcc 0
10 mol 131 unq 0 iso 0 dist 8.6243 8.71039 8.15392 6.63273 6.91348 11.6142 12.6227 9.93183 17.3411 8.70296 numMergedOcc 0
11 mol 131 unq 1 iso 0 dist 8.6243 8.71039 8.15392 6.63273 6.91348 11.6142 11.586 5.90177 8.14183 9.25558 numMergedOcc 0
12 mol 131 unq 2 iso 0 dist 8.6243 6.92648 6.01893 6.63273 6.91348 9.29384 12.6227 9.93183 10.8127 8.70296 numMergedOcc 0
13 mol 131 unq 3 iso 0 dist 8.6243 6.92648 6.01893 6.63273 6.91348 9.29384 11.586 5.90177 11.2516 9.25558 numMergedOcc 0
14 mol 134 unq 0 iso 0 dist 8.79571 8.20836 9.65798 8.80819 8.6355 13.846 10.5252 14.1488 14.2253 7.80532 numMergedOcc 0
15 mol 194 unq 0 iso 0 dist 8.38695 8.2654 6.8278 8.48054 6.47873 6.26839 13.9101 10.7231 5.92931 8.65535 numMergedOcc 0
16 mol 234 unq 0 iso 0 dist 7.85175 7.5366 13.0974 5.88703 6.25105 8.24186 13.293 13.0631 9.68666 9.81425 numMergedOcc 0
17 mol 238 unq 0 iso 0 dist 9.68513 6.4398 6.48619 10.1648 9.29858 7.32982 10.1217 10.3809 4.77308 9.24557 numMergedOcc 0
18 mol 238 unq 1 iso 0 dist 5.9216 6.4398 5.8333 5.40359 9.90142 6.66971 10.1217 10.3147 4.77308 7.57812 numMergedOcc 0
19 mol 238 unq 2 iso 0 dist 5.9216 6.4398 5.8333 5.40359 9.90142 6.66971 13.492 15.6823 10.2777 8.69104 numMergedOcc 0
20 mol 240 unq 0 iso 0 dist 7.03489 8.44909 9.75032 4.28414 6.15305 9.47583 10.5594 9.66581 15.5587 6.68687 numMergedOcc 0
