0 mol 7 unq 0 iso 0 dist 6.22892 5.13744 6.36911 15.5737 9.68596 13.0969 numMergedOcc 0
1 mol 9 unq 0 iso 0 dist 9.4523 13.8846 9.87449 14.5187 8.64915 10.9409 numMergedOcc 0
2 mol 9 unq 1 iso 0 dist 9.4523 13.8846 9.87449 10.6489 8.17347 8.50857 numMergedOcc 0
3 mol 9 unq 2 iso 0 dist 9.4523 13.8846 9.87449 7.17062 7.83133 6.89307 numMergedOcc 0
4 mol 11 unq 0 iso 0 dist 6.97875 7.75648 9.53002 6.15351 4.30695 11.9464 numMergedOcc 0
5 mol 11 unq 1 iso 0 dist 6.97875 7.75648 9.53002 4.69415 6.35398 7.5901 numMergedOcc 0
6 mol 24 unq 0 iso 0 dist 6.85331 8.91397 9.75144 10.7574 7.33768 5.90981 numMergedOcc 0
7 mol 24 unq 1 iso 0 dist 6.85331 8.91397 9.75144 15.2995 9.01567 13.2265 numMergedOcc 0
8 mol 24 unq 2 iso 0 dist 6.85331 8.91397 9.75144 12.8157 7.29868 13.719 numMergedOcc 0
9 mol 119 unq 0 iso 0 dist 6.85677 9.87733 9.80862 5.00632 6.73586 4.95807 numMergedOcc 0
10 mol 119 unq 1 iso 0 dist 6.85677 11.7378 8.43904 5.00632 6.73586 7.39626 numMergedOcc 0
11 mol 124 unq 0 iso 0 dist 7.23052 10.5562 6.83051 5.34732 6.96281 6.89396 numMergedOcc 0
12 mol 124 unq 1 iso 0 dist 7.23052 12.5603 9.28376 5.34732 6.96281 7.66641 numMergedOcc 0
13 mol 134 unq 0 iso 0 dist 7.97208 6.30187 8.6355 15.4716 7.80532 14.1488 numMergedOcc 0
14 mol 155 unq 0 iso 0 dist 8.66709 7.00069 7.39644 12.1461 6.53347 6.40403 numMergedOcc 0
15 mol 155 unq 1 iso 0 dist 8.66709 14.2312 7.70572 12.1461 6.53347 4.40321 numMergedOcc 0
16 mol 181 unq 0 iso 0 dist 9.63295 10.602 6.93764 14.1039 5.9176 5.60306 numMergedOcc 0
17 mol 181 unq 1 iso 0 dist 9.63295 10.602 6.93764 5.39949 6.41453 6.05477 numMergedOcc 0
18 mol 204 unq 0 iso 0 dist 7.7292 11.695 5.90931 16.5925 9.68728 11.145 numMergedOcc 0
19 mol 218 unq 0 iso 0 dist 9.88212 13.5954 7.18041 8.22785 6.1951 6.16211 numMergedOcc 0
20 mol 218 unq 1 iso 0 dist 9.88212 12.7227 7.17547 8.22785 6.1951 7.21048 numMergedOcc 0
21 mol 219 unq 0 iso 0 dist 9.68515 6.50565 4.87541 4.06981 7.59632 3.92926 numMergedOcc 0
22 mol 219 unq 1 iso 0 dist 8.09769 7.42613 4.87541 6.66401 7.59632 3.92926 numMergedOcc 0
23 mol 219 unq 2 iso 0 dist 6.75833 5.58412 4.87541 9.30251 7.59632 3.92926 numMergedOcc 0
24 mol 222 unq 0 iso 0 dist 8.69148 8.62626 6.82208 8.56453 7.67576 7.39748 numMergedOcc 0
25 mol 222 unq 1 iso 0 dist 8.69148 8.62626 6.82208 13.6076 9.82371 5.08928 numMergedOcc 0
26 mol 224 unq 0 iso 0 dist 7.04127 9.20195 8.19953 13.4507 9.51597 6.99977 numMergedOcc 0
27 mol 238 unq 0 iso 0 dist 8.89538 13.2905 6.77463 16.6173 8.67864 4.38002 numMergedOcc 0
28 mol 238 unq 1 iso 0 dist 8.89538 10.4286 7.2766 16.6173 8.67864 11.5793 numMergedOcc 0
29 mol 240 unq 0 iso 0 dist 6.01168 6.40204 6.15305 6.08726 6.68687 9.66581 numMergedOcc 0
30 mol 240 unq 1 iso 0 dist 6.01168 11.4113 8.0951 6.08726 6.68687 7.03039 numMergedOcc 0
31 mol 240 unq 2 iso 0 dist 6.83069 10.6805 6.15305 10.24 6.68687 9.66581 numMergedOcc 0
32 mol 240 unq 3 iso 0 dist 6.83069 5.79056 8.0951 10.24 6.68687 7.03039 numMergedOcc 0
33 mol 284 unq 0 iso 0 dist 9.41428 5.90634 8.41504 6.5455 7.8343 5.39591 numMergedOcc 0
34 mol 284 unq 1 iso 0 dist 7.32482 9.91995 8.41504 5.40432 7.8343 5.39591 numMergedOcc 0
35 mol 284 unq 2 iso 0 dist 8.08993 9.65436 8.41504 7.98227 7.8343 5.39591 numMergedOcc 0
36 mol 284 unq 3 iso 0 dist 7.34344 5.83318 4.86729 6.50962 6.78191 6.76453 numMergedOcc 0
