0 mol 18 unq 0 iso 0 dist 7.23594 5.03451 10.0997 8.93027 15.5941 7.94376 numMergedOcc 0
1 mol 46 unq 0 iso 0 dist 9.31319 5.92771 7.13979 6.92761 12.5566 5.53419 numMergedOcc 0
2 mol 46 unq 1 iso 0 dist 8.2513 5.92771 9.26597 6.92761 13.0114 5.53419 numMergedOcc 0
3 mol 54 unq 0 iso 0 dist 7.51978 7.18148 13.8618 6.85941 10.4031 8.75957 numMergedOcc 0
4 mol 103 unq 0 iso 0 dist 5.94478 7.85115 8.02001 9.41836 11.9098 5.51053 numMergedOcc 0
5 mol 143 unq 0 iso 0 dist 8.72463 7.99127 6.75249 10.4027 9.14266 7.2932 numMergedOcc 0
6 mol 148 unq 0 iso 0 dist 9.7168 7.91749 6.77599 6.57631 9.99156 8.74878 numMergedOcc 0
7 mol 148 unq 1 iso 0 dist 7.38138 7.91749 10.2375 6.57631 12.1227 8.74878 numMergedOcc 0
8 mol 150 unq 0 iso 0 dist 9.61132 7.96309 6.74495 6.56068 9.8656 8.74018 numMergedOcc 0
9 mol 150 unq 1 iso 0 dist 7.34423 7.96309 10.2651 6.56068 12.1516 8.74018 numMergedOcc 0
10 mol 153 unq 0 iso 0 dist 9.56587 5.17415 6.14894 5.84134 11.8199 7.97325 numMergedOcc 0
11 mol 158 unq 0 iso 0 dist 8.1504 4.88625 5.74997 7.33177 11.931 7.20362 numMergedOcc 0
12 mol 182 unq 0 iso 0 dist 7.8621 7.01577 6.1548 5.77163 7.09394 9.02127 numMergedOcc 0
13 mol 186 unq 0 iso 0 dist 8.08787 7.93815 4.63377 13.1468 11.6901 8.2241 numMergedOcc 0
14 mol 198 unq 0 iso 0 dist 5.80867 7.48253 4.27652 6.42799 6.34616 8.78623 numMergedOcc 0
15 mol 198 unq 1 iso 0 dist 9.4363 6.13687 4.27652 10.4394 6.34616 8.78623 numMergedOcc 0
16 mol 213 unq 0 iso 0 dist 6.82185 7.86605 4.71943 10.6201 7.37798 9.34602 numMergedOcc 0
17 mol 213 unq 1 iso 0 dist 6.82881 7.86605 3.62097 10.6201 11.8877 9.34602 numMergedOcc 0
18 mol 214 unq 0 iso 0 dist 9.01896 7.81831 7.79075 10.2269 12.9775 8.41013 numMergedOcc 0
19 mol 249 unq 0 iso 0 dist 6.93507 6.32658 5.57138 5.74889 10.0024 8.76518 numMergedOcc 0
20 mol 249 unq 1 iso 0 dist 6.42827 6.32658 10.3504 5.74889 5.48118 8.76518 numMergedOcc 0
21 mol 287 unq 0 iso 0 dist 9.22576 8.08382 6.68639 10.1822 13.9241 8.58427 numMergedOcc 0
22 mol 288 unq 0 iso 0 dist 9.22576 8.08382 6.68639 10.1822 13.9241 8.58427 numMergedOcc 0
23 mol 289 unq 0 iso 0 dist 9.22576 8.08382 6.68639 10.1822 13.9241 8.58427 numMergedOcc 0
24 mol 294 unq 0 iso 0 dist 9.6958 5.00754 9.80923 5.85169 12.4505 9.01437 numMergedOcc 0
