0 mol 15 unq 0 iso 0 dist 9.55181 7.16107 8.111 7.87072 4.41883 9.97769 numMergedOcc 0
1 mol 25 unq 0 iso 0 dist 6.34277 4.68147 7.05196 8.50539 5.8503 5.77745 numMergedOcc 0
2 mol 25 unq 1 iso 0 dist 9.40763 9.41688 7.05196 13.3161 5.8503 5.77745 numMergedOcc 0
3 mol 25 unq 2 iso 0 dist 8.46842 5.03904 4.79873 8.83402 5.59268 8.27137 numMergedOcc 0
4 mol 45 unq 0 iso 0 dist 8.43515 3.96994 5.94756 11.7774 5.68664 8.69574 numMergedOcc 0
5 mol 78 unq 0 iso 0 dist 8.40871 10.8182 6.85523 5.8409 7.17843 7.32064 numMergedOcc 0
6 mol 78 unq 1 iso 0 dist 8.40871 10.8182 6.85523 8.13368 4.4651 4.62314 numMergedOcc 0
7 mol 78 unq 2 iso 0 dist 8.40871 3.48199 5.77326 5.8409 7.17843 5.85007 numMergedOcc 0
8 mol 78 unq 3 iso 0 dist 8.40871 3.48199 5.77326 8.13368 4.4651 6.35234 numMergedOcc 0
9 mol 98 unq 0 iso 0 dist 9.48388 4.54306 7.78931 4.3761 12.3835 5.33961 numMergedOcc 0
10 mol 98 unq 1 iso 0 dist 9.48388 4.54306 7.78931 10.6512 16.3389 9.29816 numMergedOcc 0
11 mol 98 unq 2 iso 0 dist 9.48388 4.54306 7.78931 5.84583 4.96747 5.08983 numMergedOcc 0
12 mol 98 unq 3 iso 0 dist 9.48388 10.9661 8.7497 17.6857 13.9599 8.3505 numMergedOcc 0
13 mol 129 unq 0 iso 0 dist 6.1421 5.75588 5.51197 4.76012 6.43966 6.53559 numMergedOcc 0
14 mol 129 unq 1 iso 0 dist 6.1421 5.75588 5.51197 11.3542 5.56946 8.09774 numMergedOcc 0
15 mol 129 unq 2 iso 0 dist 6.1421 4.18263 8.86944 4.76012 6.43966 7.90844 numMergedOcc 0
16 mol 129 unq 3 iso 0 dist 9.54663 11.0564 5.51197 12.7872 6.43966 6.53559 numMergedOcc 0
17 mol 129 unq 4 iso 0 dist 9.54663 11.0564 5.51197 13.9359 5.56946 8.09774 numMergedOcc 0
18 mol 129 unq 5 iso 0 dist 9.54663 7.22602 8.86944 12.7872 6.43966 7.90844 numMergedOcc 0
19 mol 131 unq 0 iso 0 dist 7.49404 7.08715 9.27976 7.56833 5.6098 9.10434 numMergedOcc 0
20 mol 144 unq 0 iso 0 dist 9.73668 8.35821 7.64028 10.1522 4.6812 7.46026 numMergedOcc 0
21 mol 197 unq 0 iso 0 dist 7.18765 4.26432 9.10817 8.05227 7.56497 6.0033 numMergedOcc 0
22 mol 197 unq 1 iso 0 dist 7.41091 4.26432 6.86828 8.05227 5.66137 6.0033 numMergedOcc 0
23 mol 213 unq 0 iso 0 dist 9.24466 7.14533 7.94911 14.5769 7.05959 9.45658 numMergedOcc 0
24 mol 233 unq 0 iso 0 dist 4.94074 7.83075 8.51625 8.73545 6.52848 7.1229 numMergedOcc 0
25 mol 233 unq 1 iso 0 dist 4.94074 7.83075 8.51625 8.14581 5.51 9.55705 numMergedOcc 0
26 mol 257 unq 0 iso 0 dist 6.50405 9.94726 8.83833 11.5923 6.45947 8.70029 numMergedOcc 0
27 mol 259 unq 0 iso 0 dist 9.89728 13.7396 5.85442 12.4734 5.41945 4.95855 numMergedOcc 0
28 mol 259 unq 1 iso 0 dist 9.89728 15.7491 6.95511 12.4734 5.41945 7.72489 numMergedOcc 0
29 mol 264 unq 0 iso 0 dist 8.43682 4.66338 9.19754 13.0943 11.5671 9.13546 numMergedOcc 0
30 mol 264 unq 1 iso 0 dist 8.43682 4.66338 9.19754 5.03174 5.21164 7.19658 numMergedOcc 0
31 mol 264 unq 2 iso 0 dist 6.20796 4.66338 8.29262 13.0943 13.8765 9.13546 numMergedOcc 0
32 mol 264 unq 3 iso 0 dist 6.20796 4.66338 8.29262 5.03174 6.12009 7.19658 numMergedOcc 0
33 mol 264 unq 4 iso 0 dist 7.73693 10.3972 8.29262 18.4101 13.8765 9.13546 numMergedOcc 0
34 mol 264 unq 5 iso 0 dist 7.73693 10.3972 8.29262 7.22743 6.12009 7.19658 numMergedOcc 0
35 mol 270 unq 0 iso 0 dist 9.02113 4.65147 9.31275 4.60602 5.00269 6.46935 numMergedOcc 0
36 mol 270 unq 1 iso 0 dist 9.02113 7.14116 8.56508 4.60602 5.00269 5.98384 numMergedOcc 0
37 mol 292 unq 0 iso 0 dist 6.87804 4.77692 7.20674 6.84909 8.04474 5.72473 numMergedOcc 0
38 mol 292 unq 1 iso 0 dist 6.07571 11.6413 7.20674 10.1584 8.04474 5.72473 numMergedOcc 0
