0 mol 8 unq 0 iso 0 dist 8.33604 4.85329 6.26865 5.89134 5.93269 5.99042 numMergedOcc 0
1 mol 9 unq 0 iso 0 dist 8.47421 11.4878 7.2199 13.8869 6.54865 5.80845 numMergedOcc 0
2 mol 9 unq 1 iso 0 dist 6.33889 4.61049 6.9513 11.3398 5.97048 9.76103 numMergedOcc 0
3 mol 9 unq 2 iso 0 dist 6.33889 4.61049 6.9513 13.1353 11.9271 9.79343 numMergedOcc 0
4 mol 9 unq 3 iso 0 dist 6.33889 6.64015 9.16116 13.1353 11.9271 8.21283 numMergedOcc 0
5 mol 9 unq 4 iso 0 dist 6.33889 13.7377 8.47109 11.3398 5.97048 7.76353 numMergedOcc 0
6 mol 15 unq 0 iso 0 dist 9.78051 5.51916 8.96967 11.9723 12.8592 6.52627 numMergedOcc 0
7 mol 15 unq 1 iso 0 dist 9.78051 5.51916 8.96967 8.63502 5.3298 9.90484 numMergedOcc 0
8 mol 72 unq 0 iso 0 dist 7.321 7.17489 8.59747 13.6124 10.0612 8.5576 numMergedOcc 0
9 mol 88 unq 0 iso 0 dist 8.66514 5.90098 7.71582 6.066 7.39092 9.64465 numMergedOcc 0
10 mol 88 unq 1 iso 0 dist 9.25235 5.90098 6.65776 6.066 8.30564 9.64465 numMergedOcc 0
11 mol 99 unq 0 iso 0 dist 7.72108 5.81128 6.6925 13.459 8.23 9.16064 numMergedOcc 0
12 mol 115 unq 0 iso 0 dist 7.76729 10.2377 6.40036 13.8627 6.16016 8.06435 numMergedOcc 0
13 mol 127 unq 0 iso 0 dist 6.192 8.00931 6.3244 10.4231 4.98036 6.11979 numMergedOcc 0
14 mol 127 unq 1 iso 0 dist 7.69308 6.85862 6.3244 11.0323 4.98036 6.11979 numMergedOcc 0
15 mol 127 unq 2 iso 0 dist 8.59981 4.77464 6.3244 5.72373 4.98036 6.11979 numMergedOcc 0
16 mol 127 unq 3 iso 0 dist 7.66331 7.11695 6.3244 7.20988 4.98036 6.11979 numMergedOcc 0
17 mol 133 unq 0 iso 0 dist 7.92688 11.8989 9.94276 9.40521 6.14787 8.21182 numMergedOcc 0
18 mol 133 unq 1 iso 0 dist 7.92688 15.0734 9.05357 9.40521 6.14787 7.5547 numMergedOcc 0
19 mol 133 unq 2 iso 0 dist 7.92688 9.58627 5.99299 9.40521 6.14787 9.31771 numMergedOcc 0
20 mol 194 unq 0 iso 0 dist 6.95408 7.11879 6.41318 9.98761 5.14638 5.11333 numMergedOcc 0
21 mol 194 unq 1 iso 0 dist 9.57538 8.89656 6.41318 12.1051 5.14638 5.11333 numMergedOcc 0
22 mol 194 unq 2 iso 0 dist 9.2285 7.8502 6.41318 10.133 5.14638 5.11333 numMergedOcc 0
23 mol 194 unq 3 iso 0 dist 7.58278 7.82648 6.41318 7.61316 5.14638 5.11333 numMergedOcc 0
24 mol 213 unq 0 iso 0 dist 8.45368 11.1059 8.74171 13.2461 8.3461 5.18463 numMergedOcc 0
25 mol 213 unq 1 iso 0 dist 9.59129 12.2579 8.74171 8.29133 8.3461 5.18463 numMergedOcc 0
26 mol 225 unq 0 iso 0 dist 5.50387 10.7506 8.75834 15 11.6618 9.15712 numMergedOcc 0
27 mol 225 unq 1 iso 0 dist 5.50387 7.12954 9.36396 9.31373 7.96309 5.74825 numMergedOcc 0
28 mol 234 unq 0 iso 0 dist 9.5707 5.56749 8.49841 6.35438 10.0213 9.76304 numMergedOcc 0
29 mol 234 unq 1 iso 0 dist 9.5707 12.1076 9.6101 12.2772 13.7546 6.92793 numMergedOcc 0
30 mol 234 unq 2 iso 0 dist 9.5707 12.1076 9.6101 6.35438 10.0213 8.83027 numMergedOcc 0
31 mol 234 unq 3 iso 0 dist 6.16063 5.9221 8.49841 7.27632 10.6582 6.55256 numMergedOcc 0
32 mol 234 unq 4 iso 0 dist 9.39181 6.29366 5.32183 9.07916 4.86801 6.92793 numMergedOcc 0
33 mol 234 unq 5 iso 0 dist 9.39181 6.29366 5.32183 9.57132 5.16504 8.83027 numMergedOcc 0
34 mol 239 unq 0 iso 0 dist 7.39747 7.04058 6.34801 11.9599 11.3738 9.95624 numMergedOcc 0
