0 mol 7 unq 0 iso 0 dist 8.98901 6.16125 4.48817 8.75465 7.98039 4.40641 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.98901 6.16125 4.48817 8.00249 8.97003 5.03278 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 8.98901 9.34656 5.9201 8.75465 7.98039 7.92429 numMergedOcc 0
3 mol 7 unq 3 iso 0 dist 8.98901 9.34656 5.9201 8.00249 8.97003 11.2233 numMergedOcc 0
4 mol 18 unq 0 iso 0 dist 9.4649 8.95573 10.3579 8.1133 12.14 13.1509 numMergedOcc 0
5 mol 18 unq 1 iso 0 dist 9.4649 8.95573 10.3579 8.44727 12.9864 5.69024 numMergedOcc 0
6 mol 18 unq 2 iso 0 dist 6.45965 8.95573 5.867 8.1133 10.8265 13.1509 numMergedOcc 0
7 mol 18 unq 3 iso 0 dist 6.45965 8.95573 5.867 8.44727 3.91445 5.69024 numMergedOcc 0
8 mol 33 unq 0 iso 0 dist 5.32407 8.52627 8.17675 9.67585 9.3686 4.05766 numMergedOcc 0
9 mol 33 unq 1 iso 0 dist 6.53102 8.52627 5.82516 9.67585 8.49894 4.05766 numMergedOcc 0
10 mol 33 unq 2 iso 0 dist 7.76575 8.52627 4.87306 9.67585 5.75951 4.05766 numMergedOcc 0
11 mol 33 unq 3 iso 0 dist 9.74394 8.52627 7.1347 9.67585 3.82391 4.05766 numMergedOcc 0
12 mol 34 unq 0 iso 0 dist 9.12062 5.73257 10.7494 5.39587 13.3334 8.82586 numMergedOcc 0
13 mol 34 unq 1 iso 0 dist 9.12062 5.73257 10.7494 6.47252 8.73415 5.65179 numMergedOcc 0
14 mol 54 unq 0 iso 0 dist 6.35249 6.21143 5.27577 6.94712 6.10822 6.06742 numMergedOcc 0
15 mol 70 unq 0 iso 0 dist 9.2794 8.06918 11.9871 8.63204 11.0976 15.7824 numMergedOcc 0
16 mol 70 unq 1 iso 0 dist 9.2794 8.06918 11.9871 5.4014 6.92915 12.3616 numMergedOcc 0
17 mol 70 unq 2 iso 0 dist 9.2794 7.52623 9.5704 8.63204 11.0976 13.3187 numMergedOcc 0
18 mol 70 unq 3 iso 0 dist 9.2794 7.52623 9.5704 5.4014 6.92915 10.3115 numMergedOcc 0
19 mol 70 unq 4 iso 0 dist 9.2794 5.62294 10.9277 8.63204 11.0976 4.77578 numMergedOcc 0
20 mol 70 unq 5 iso 0 dist 9.2794 5.62294 10.9277 5.4014 6.92915 4.14483 numMergedOcc 0
21 mol 122 unq 0 iso 0 dist 8.3907 9.55337 5.73775 6.91978 3.65582 6.08654 numMergedOcc 0
22 mol 133 unq 0 iso 0 dist 8.78 7.17226 4.49984 8.8639 8.60388 10.8097 numMergedOcc 0
23 mol 133 unq 1 iso 0 dist 8.78 7.17226 4.49984 7.32009 10.0489 11.5282 numMergedOcc 0
24 mol 134 unq 0 iso 0 dist 8.49649 5.98435 11.5532 7.96353 11.0328 13.6552 numMergedOcc 0
25 mol 134 unq 1 iso 0 dist 8.49649 8.80672 14.5276 7.96353 11.0328 4.44936 numMergedOcc 0
26 mol 154 unq 0 iso 0 dist 9.71025 5.81632 6.28784 8.59532 7.4198 9.6584 numMergedOcc 0
27 mol 194 unq 0 iso 0 dist 8.40769 9.20864 10.2713 9.3228 3.66945 8.40013 numMergedOcc 0
28 mol 195 unq 0 iso 0 dist 8.51112 8.64561 5.86183 8.08491 3.58901 8.82601 numMergedOcc 0
29 mol 205 unq 0 iso 0 dist 8.95136 6.37411 15.2718 9.71147 11.9786 11.7202 numMergedOcc 0
30 mol 205 unq 1 iso 0 dist 8.95136 6.37411 15.2718 6.32553 10.0544 9.116 numMergedOcc 0
31 mol 220 unq 0 iso 0 dist 9.39546 5.13604 4.8744 7.71199 5.9986 4.42755 numMergedOcc 0
32 mol 220 unq 1 iso 0 dist 4.17978 5.13604 3.90017 7.71199 4.94998 4.42755 numMergedOcc 0
33 mol 233 unq 0 iso 0 dist 8.36772 5.34745 8.95188 9.00218 6.88396 6.206 numMergedOcc 0
34 mol 233 unq 1 iso 0 dist 8.36772 5.34745 8.95188 6.0751 6.41724 6.80416 numMergedOcc 0
35 mol 233 unq 2 iso 0 dist 8.83541 5.34745 5.19341 9.00218 8.71119 6.206 numMergedOcc 0
36 mol 233 unq 3 iso 0 dist 8.83541 5.34745 5.19341 6.0751 10.8172 6.80416 numMergedOcc 0
37 mol 233 unq 4 iso 0 dist 7.55878 5.34745 5.3674 9.00218 3.66075 6.206 numMergedOcc 0
38 mol 233 unq 5 iso 0 dist 7.55878 5.34745 5.3674 6.0751 3.98113 6.80416 numMergedOcc 0
39 mol 233 unq 6 iso 0 dist 4.91191 7.99897 5.3674 7.69531 3.66075 6.206 numMergedOcc 0
40 mol 234 unq 0 iso 0 dist 5.65943 7.54327 4.21173 8.56943 4.86668 6.00588 numMergedOcc 0
41 mol 247 unq 0 iso 0 dist 6.35578 6.34304 4.32191 8.85175 7.1875 8.72814 numMergedOcc 0
42 mol 248 unq 0 iso 0 dist 8.4908 7.96942 8.23532 5.65458 3.67057 6.71098 numMergedOcc 0
