0 mol 0 unq 0 iso 0 dist 9.6994 6.26831 6.34883 7.40865 9.11323 5.73813 5.24778 11.2072 6.64713 10.4616 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 7.15528 6.26831 9.19662 7.40865 9.46298 5.73813 5.24778 11.2263 6.64713 10.4616 numMergedOcc 0
2 mol 8 unq 0 iso 0 dist 8.96553 7.3915 7.43529 8.53529 4.36226 5.65816 14.1378 14.9611 8.77457 11.3039 numMergedOcc 0
3 mol 19 unq 0 iso 0 dist 7.20519 6.92532 12.3486 7.75618 4.96411 13.9675 4.97119 10.741 6.39966 9.95212 numMergedOcc 0
4 mol 19 unq 1 iso 0 dist 4.54938 6.92532 5.18512 7.75618 9.74255 13.9675 4.97119 6.41575 6.39966 9.95212 numMergedOcc 0
5 mol 19 unq 2 iso 0 dist 6.864 6.92532 9.47529 7.75618 7.08342 13.9675 4.97119 6.41423 6.39966 9.95212 numMergedOcc 0
6 mol 24 unq 0 iso 0 dist 6.86014 6.60423 6.00575 9.41441 6.66749 11.9395 4.32034 7.33768 9.69752 8.00171 numMergedOcc 0
7 mol 24 unq 1 iso 0 dist 6.86014 6.60423 6.00575 9.41441 6.66749 11.9395 8.52463 7.29868 9.36461 6.72323 numMergedOcc 0
8 mol 24 unq 2 iso 0 dist 8.86116 6.60423 5.97304 9.41441 14.012 11.9395 4.32034 12.9284 9.69752 8.00171 numMergedOcc 0
9 mol 24 unq 3 iso 0 dist 8.86116 6.60423 5.97304 9.41441 14.012 11.9395 8.52463 8.60554 9.36461 6.72323 numMergedOcc 0
10 mol 24 unq 4 iso 0 dist 5.54419 4.93188 4.33963 8.70827 5.59311 9.75636 5.11617 8.4051 4.90592 12.8389 numMergedOcc 0
11 mol 24 unq 5 iso 0 dist 5.54419 4.93188 4.33963 8.70827 5.59311 9.75636 10.8238 8.75662 8.16324 11.6684 numMergedOcc 0
12 mol 24 unq 6 iso 0 dist 5.54419 4.93188 4.33963 6.73939 12.176 10.0715 5.11617 8.4051 4.90592 6.72323 numMergedOcc 0
13 mol 24 unq 7 iso 0 dist 5.54419 4.93188 4.33963 6.73939 12.176 10.0715 10.8238 8.75662 8.16324 15.7523 numMergedOcc 0
14 mol 24 unq 8 iso 0 dist 7.36323 9.24958 4.33963 9.12854 5.59311 9.75636 13.2229 8.4051 4.90592 12.8389 numMergedOcc 0
15 mol 24 unq 9 iso 0 dist 7.36323 9.24958 4.33963 9.12854 5.59311 9.75636 6.7828 8.75662 8.16324 11.6684 numMergedOcc 0
16 mol 56 unq 0 iso 0 dist 8.66265 6.77886 6.03623 7.16773 6.63327 8.25666 10.0962 11.8747 6.99108 14.7378 numMergedOcc 0
17 mol 60 unq 0 iso 0 dist 8.7531 7.55695 9.62257 9.90939 7.04075 4.82351 5.94827 11.816 4.65127 8.97364 numMergedOcc 0
18 mol 98 unq 0 iso 0 dist 5.08437 7.26086 7.32662 6.65501 4.4057 11.2092 7.06961 6.7117 8.43352 6.88901 numMergedOcc 0
19 mol 98 unq 1 iso 0 dist 6.48948 7.26086 13.4985 6.65501 7.42446 11.2092 7.06961 9.42961 8.43352 6.88901 numMergedOcc 0
20 mol 98 unq 2 iso 0 dist 6.10456 7.26086 6.934 6.65501 9.67482 11.2092 7.06961 4.47349 8.43352 6.88901 numMergedOcc 0
21 mol 100 unq 0 iso 0 dist 6.45675 7.12017 9.52882 7.38135 7.11701 9.38256 9.75737 15.8683 9.5669 14.4785 numMergedOcc 0
22 mol 100 unq 1 iso 0 dist 7.47343 7.12017 12.6602 7.38135 11.2312 9.38256 9.75737 16.5404 9.5669 14.4785 numMergedOcc 0
23 mol 100 unq 2 iso 0 dist 8.86688 7.12017 14.8674 7.38135 7.79768 9.38256 9.75737 16.3323 9.5669 14.4785 numMergedOcc 0
24 mol 114 unq 0 iso 0 dist 7.5732 6.34525 11.128 6.84011 7.436 8.51024 12.7083 19.2926 9.35942 14.1286 numMergedOcc 0
25 mol 129 unq 0 iso 0 dist 5.83384 8.03372 6.67948 9.36851 10.7293 6.84211 4.55551 6.28565 9.94578 9.73158 numMergedOcc 0
26 mol 129 unq 1 iso 0 dist 5.83384 8.03372 6.67948 4.97175 7.29399 4.53459 4.55551 6.28565 9.94578 7.59327 numMergedOcc 0
27 mol 131 unq 0 iso 0 dist 6.85062 9.29384 9.32969 8.70296 14.2045 10.8127 13.1439 11.8327 5.44303 15.6807 numMergedOcc 0
28 mol 131 unq 1 iso 0 dist 6.85062 9.29384 9.32969 8.70296 14.2045 10.8127 13.7237 9.90168 8.50562 18.6956 numMergedOcc 0
29 mol 131 unq 2 iso 0 dist 6.85062 9.29384 9.32969 9.25558 5.09131 11.2516 13.1439 11.8327 5.44303 14.8175 numMergedOcc 0
30 mol 131 unq 3 iso 0 dist 6.85062 9.29384 9.32969 9.25558 5.09131 11.2516 13.7237 9.90168 8.50562 13.2952 numMergedOcc 0
31 mol 156 unq 0 iso 0 dist 8.34702 5.38091 10.7023 7.30357 10.4977 12.4049 5.81563 13.0658 7.46845 8.21184 numMergedOcc 0
32 mol 156 unq 1 iso 0 dist 8.34702 5.38091 10.7023 8.61587 12.4274 11.7015 5.81563 13.0658 7.46845 5.9976 numMergedOcc 0
33 mol 156 unq 2 iso 0 dist 9.06726 5.38091 9.00862 7.30357 12.3086 12.4049 5.81563 11.5017 7.46845 8.21184 numMergedOcc 0
34 mol 156 unq 3 iso 0 dist 9.06726 5.38091 9.00862 8.61587 10.9151 11.7015 5.81563 11.5017 7.46845 5.9976 numMergedOcc 0
35 mol 156 unq 4 iso 0 dist 8.33171 5.38091 11.1271 7.30357 7.79535 12.4049 5.81563 10.0063 7.46845 8.21184 numMergedOcc 0
36 mol 156 unq 5 iso 0 dist 8.33171 5.38091 11.1271 8.61587 6.98125 11.7015 5.81563 10.0063 7.46845 5.9976 numMergedOcc 0
37 mol 175 unq 0 iso 0 dist 9.29945 7.35824 12.5754 9.39352 7.27408 10.3786 11.8693 17.6416 5.89564 16.2138 numMergedOcc 0
38 mol 175 unq 1 iso 0 dist 9.29945 7.35824 12.5754 9.39352 7.27408 10.3786 6.77832 12.6314 5.60528 13.4698 numMergedOcc 0
39 mol 175 unq 2 iso 0 dist 9.29945 9.17364 10.0424 9.39352 7.27408 11.9672 6.77832 12.6314 5.5995 13.4698 numMergedOcc 0
40 mol 181 unq 0 iso 0 dist 9.1374 6.51749 13.8722 8.90963 8.91338 13.0913 5.6044 14.2254 7.11785 10.515 numMergedOcc 0
41 mol 181 unq 1 iso 0 dist 5.98885 6.51749 5.93488 8.90963 9.81073 13.0913 5.6044 9.72611 7.11785 10.515 numMergedOcc 0
42 mol 181 unq 2 iso 0 dist 9.15386 6.51749 7.64267 8.90963 9.34211 13.0913 5.6044 10.428 7.11785 10.515 numMergedOcc 0
43 mol 204 unq 0 iso 0 dist 7.10633 6.85441 8.17229 9.68728 7.67571 5.42649 5.86489 11.5776 5.91727 10.2072 numMergedOcc 0
44 mol 204 unq 1 iso 0 dist 8.51516 6.85441 5.74707 9.68728 10.8573 5.42649 5.86489 7.32294 5.91727 10.2072 numMergedOcc 0
45 mol 205 unq 0 iso 0 dist 7.26832 5.60393 5.28092 5.44002 10.3603 8.46033 14.4523 9.53629 9.17946 17.31 numMergedOcc 0
46 mol 232 unq 0 iso 0 dist 8.27212 7.83711 8.25884 9.05071 8.80479 13.8622 4.9377 9.40808 6.57921 9.8664 numMergedOcc 0
47 mol 258 unq 0 iso 0 dist 6.60405 6.70815 7.42673 7.21311 5.63675 8.10604 10.8558 15.8417 9.91199 16.0544 numMergedOcc 0
48 mol 274 unq 0 iso 0 dist 7.56915 9.56685 5.90436 9.85289 6.20558 5.36428 5.29529 8.52587 8.2997 6.88827 numMergedOcc 0
49 mol 274 unq 1 iso 0 dist 8.49997 9.56685 12.106 9.85289 11.4459 5.36428 5.29529 11.6126 8.2997 6.88827 numMergedOcc 0
