0 mol 7 unq 0 iso 0 dist 8.14952 5.83658 4.92824 4.47024 5.86605 6.58469 numMergedOcc 0
1 mol 8 unq 0 iso 0 dist 9.00925 8.89145 5.7343 9.95165 14.4767 12.1308 numMergedOcc 0
2 mol 8 unq 1 iso 0 dist 9.00925 6.92865 11.3728 9.95165 14.4767 5.02333 numMergedOcc 0
3 mol 19 unq 0 iso 0 dist 9.3147 7.78708 9.38012 8.75332 4.99617 6.62608 numMergedOcc 0
4 mol 19 unq 1 iso 0 dist 9.3147 7.84393 10.5285 8.75332 4.99617 6.49317 numMergedOcc 0
5 mol 19 unq 2 iso 0 dist 9.79426 7.78708 9.55318 8.75332 13.9869 6.62608 numMergedOcc 0
6 mol 19 unq 3 iso 0 dist 9.79426 7.84393 9.84922 8.75332 13.9869 6.49317 numMergedOcc 0
7 mol 48 unq 0 iso 0 dist 8.36915 5.36645 8.03277 7.31914 5.09588 7.34452 numMergedOcc 0
8 mol 48 unq 1 iso 0 dist 6.01454 5.36645 9.26483 7.31914 5.01407 7.34452 numMergedOcc 0
9 mol 60 unq 0 iso 0 dist 9.54864 8.8058 6.0993 8.4928 10.5228 9.62257 numMergedOcc 0
10 mol 69 unq 0 iso 0 dist 8.36667 8.24121 14.9981 8.26633 12.6278 4.85355 numMergedOcc 0
11 mol 69 unq 1 iso 0 dist 8.36667 8.52371 13.689 8.26633 12.6278 12.7346 numMergedOcc 0
12 mol 69 unq 2 iso 0 dist 8.36667 6.8198 5.23597 8.26633 12.6278 10.7616 numMergedOcc 0
13 mol 100 unq 0 iso 0 dist 6.60356 9.57498 14.3495 6.14415 6.04919 9.52882 numMergedOcc 0
14 mol 103 unq 0 iso 0 dist 7.57822 7.55805 6.35372 9.39702 8.20815 6.29991 numMergedOcc 0
15 mol 112 unq 0 iso 0 dist 9.42175 5.81552 9.60908 6.48223 7.99528 3.98564 numMergedOcc 0
16 mol 114 unq 0 iso 0 dist 5.31281 9.24515 7.18757 7.73842 10.9798 11.128 numMergedOcc 0
17 mol 114 unq 1 iso 0 dist 8.9922 9.24515 7.13921 7.73842 15.009 11.128 numMergedOcc 0
18 mol 130 unq 0 iso 0 dist 7.9663 9.05626 9.97628 4.85559 4.79695 5.97111 numMergedOcc 0
19 mol 143 unq 0 iso 0 dist 6.68364 5.30872 5.4432 8.07799 7.37131 3.86476 numMergedOcc 0
20 mol 167 unq 0 iso 0 dist 9.82329 8.58946 13.1346 9.69541 5.68139 10.3157 numMergedOcc 0
21 mol 171 unq 0 iso 0 dist 9.47945 6.01711 5.53673 6.81707 10.6959 5.487 numMergedOcc 0
22 mol 173 unq 0 iso 0 dist 5.97008 8.84671 8.75092 4.0037 8.32122 10.7924 numMergedOcc 0
23 mol 186 unq 0 iso 0 dist 9.45817 8.03597 11.9053 4.97005 10.763 7.63746 numMergedOcc 0
24 mol 186 unq 1 iso 0 dist 9.45817 8.03597 11.9053 7.22 8.60943 5.8893 numMergedOcc 0
25 mol 186 unq 2 iso 0 dist 9.45817 8.03597 11.9053 6.81388 5.66068 6.41592 numMergedOcc 0
26 mol 186 unq 3 iso 0 dist 9.08767 9.08672 5.17355 5.67811 8.32573 5.81909 numMergedOcc 0
27 mol 186 unq 4 iso 0 dist 9.08767 9.08672 5.17355 8.74308 16.45 14.4635 numMergedOcc 0
28 mol 220 unq 0 iso 0 dist 7.35148 7.30244 10.48 8.31564 6.57369 14.3172 numMergedOcc 0
29 mol 220 unq 1 iso 0 dist 7.35148 7.29796 5.23846 8.31564 6.57369 11.1607 numMergedOcc 0
30 mol 235 unq 0 iso 0 dist 7.38609 7.93727 6.25956 9.08444 4.73244 5.70265 numMergedOcc 0
31 mol 239 unq 0 iso 0 dist 8.34832 9.27989 11.4465 9.36997 12.8764 18.6229 numMergedOcc 0
32 mol 239 unq 1 iso 0 dist 8.34832 9.27989 11.4465 9.97907 14.9673 17.6269 numMergedOcc 0
33 mol 239 unq 2 iso 0 dist 8.34832 9.27989 11.4465 8.83751 8.27455 7.34872 numMergedOcc 0
34 mol 239 unq 3 iso 0 dist 8.34832 9.27989 11.4465 8.77688 13.5505 8.9361 numMergedOcc 0
35 mol 261 unq 0 iso 0 dist 9.70222 7.6414 11.544 6.40153 7.25156 8.57648 numMergedOcc 0
36 mol 266 unq 0 iso 0 dist 9.58577 7.72749 10.2159 7.25797 5.75478 7.26083 numMergedOcc 0
37 mol 272 unq 0 iso 0 dist 7.50321 4.78812 5.96981 7.11691 9.0626 8.7909 numMergedOcc 0
38 mol 272 unq 1 iso 0 dist 7.50321 6.62923 7.55961 7.11691 9.0626 4.86504 numMergedOcc 0
39 mol 272 unq 2 iso 0 dist 9.61597 4.78812 6.76845 7.11691 8.41005 8.7909 numMergedOcc 0
40 mol 272 unq 3 iso 0 dist 9.61597 6.62923 5.43733 7.11691 8.41005 4.86504 numMergedOcc 0
41 mol 274 unq 0 iso 0 dist 6.12202 9.81087 7.96313 9.4626 7.47773 7.52207 numMergedOcc 0
42 mol 276 unq 0 iso 0 dist 8.14494 8.28881 12.431 8.18672 9.66608 8.24159 numMergedOcc 0
43 mol 276 unq 1 iso 0 dist 8.14494 5.30976 9.95911 8.18672 9.66608 4.32691 numMergedOcc 0
44 mol 279 unq 0 iso 0 dist 7.319 9.6147 13.2117 7.88343 9.1711 6.15987 numMergedOcc 0
45 mol 279 unq 1 iso 0 dist 5.78017 6.47376 5.34376 7.5355 7.91886 6.15987 numMergedOcc 0
46 mol 279 unq 2 iso 0 dist 6.12742 9.6147 5.34376 7.88343 7.91886 6.15987 numMergedOcc 0
47 mol 279 unq 3 iso 0 dist 9.45886 9.6147 10.0132 7.88343 12.8975 6.15987 numMergedOcc 0
48 mol 279 unq 4 iso 0 dist 8.78203 6.47376 5.86731 7.5355 9.00832 6.15987 numMergedOcc 0
49 mol 281 unq 0 iso 0 dist 6.7897 9.48968 5.71767 7.86146 9.96217 12.462 numMergedOcc 0
50 mol 284 unq 0 iso 0 dist 9.47963 6.86342 7.94887 9.12227 12.8423 7.09757 numMergedOcc 0
