0 mol 9 unq 0 iso 0 dist 7.05346 7.32257 8.88528 8.50424 8.076 7.35972 11.0167 14.0736 5.43306 9.93542 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 7.9944 6.55811 4.58685 6.02809 6.32226 7.35972 7.36018 5.83039 5.43306 9.93542 numMergedOcc 0
2 mol 9 unq 2 iso 0 dist 7.9944 7.36018 5.83039 6.02809 6.32226 9.93542 6.55811 4.58685 5.43306 7.35972 numMergedOcc 0
3 mol 9 unq 3 iso 0 dist 7.032 8.64915 4.58685 4.98827 6.32226 7.35972 8.17347 5.83039 5.43306 9.93542 numMergedOcc 0
4 mol 9 unq 4 iso 0 dist 7.032 8.17347 5.83039 4.98827 6.32226 9.93542 8.64915 4.58685 5.43306 7.35972 numMergedOcc 0
5 mol 24 unq 0 iso 0 dist 6.72502 8.60554 6.99746 14.012 11.5841 6.72323 12.9284 10.025 10.2653 8.00171 numMergedOcc 0
6 mol 24 unq 1 iso 0 dist 6.72502 8.60554 6.99746 14.012 11.5841 6.72323 17.592 13.0149 9.92026 5.95834 numMergedOcc 0
7 mol 24 unq 2 iso 0 dist 6.72502 8.60554 6.99746 14.012 11.5841 6.72323 13.4393 9.14963 6.16544 4.2121 numMergedOcc 0
8 mol 25 unq 0 iso 0 dist 6.90155 6.16347 11.0508 6.08585 12.7162 6.25843 13.8469 18.98 12.6805 8.88938 numMergedOcc 0
9 mol 25 unq 1 iso 0 dist 6.6492 7.45383 11.7817 5.77929 11.4352 6.25843 9.01548 9.12941 12.6805 8.88938 numMergedOcc 0
10 mol 25 unq 2 iso 0 dist 6.6492 9.01548 9.12941 5.77929 11.4352 8.88938 7.45383 11.7817 12.6805 6.25843 numMergedOcc 0
11 mol 92 unq 0 iso 0 dist 8.65802 7.52354 5.8102 14.3301 10.9559 9.91054 11.3767 11.2154 5.74171 9.60622 numMergedOcc 0
12 mol 98 unq 0 iso 0 dist 7.26086 6.65501 11.2092 7.06961 8.43352 6.88901 11.3043 8.02554 10.2754 7.36769 numMergedOcc 0
13 mol 129 unq 0 iso 0 dist 8.03372 9.36851 6.84211 4.55551 9.94578 9.73158 4.97175 4.53459 5.41583 7.59327 numMergedOcc 0
14 mol 129 unq 1 iso 0 dist 8.03372 4.97175 4.53459 4.55551 9.94578 7.59327 9.36851 6.84211 5.41583 9.73158 numMergedOcc 0
15 mol 141 unq 0 iso 0 dist 7.86572 9.97343 5.38571 9.74444 12.165 9.10042 18.8624 18.0027 12.8394 9.83945 numMergedOcc 0
16 mol 141 unq 1 iso 0 dist 7.86572 9.97343 5.38571 9.74444 12.165 9.10042 13.5519 11.7939 6.59975 6.75376 numMergedOcc 0
17 mol 156 unq 0 iso 0 dist 7.73169 7.30357 8.40261 5.81563 12.9107 8.21184 8.61587 12.8796 6.12113 5.9976 numMergedOcc 0
18 mol 156 unq 1 iso 0 dist 7.73169 7.30357 8.40261 5.52796 10.6978 5.41575 8.61587 12.8796 6.12113 6.86566 numMergedOcc 0
19 mol 156 unq 2 iso 0 dist 7.73169 8.61587 12.8796 5.81563 12.9107 5.9976 7.30357 8.40261 6.12113 8.21184 numMergedOcc 0
20 mol 156 unq 3 iso 0 dist 7.73169 8.61587 12.8796 5.52796 10.6978 6.86566 7.30357 8.40261 6.12113 5.41575 numMergedOcc 0
21 mol 156 unq 4 iso 0 dist 5.38091 7.30357 12.4049 5.81563 7.46845 8.21184 8.61587 11.7015 6.12113 5.9976 numMergedOcc 0
22 mol 156 unq 5 iso 0 dist 5.38091 7.30357 12.4049 5.52796 9.59889 5.41575 8.61587 11.7015 6.12113 6.86566 numMergedOcc 0
23 mol 156 unq 6 iso 0 dist 5.38091 8.61587 11.7015 5.81563 7.46845 5.9976 7.30357 12.4049 6.12113 8.21184 numMergedOcc 0
24 mol 156 unq 7 iso 0 dist 5.38091 8.61587 11.7015 5.52796 9.59889 6.86566 7.30357 12.4049 6.12113 5.41575 numMergedOcc 0
25 mol 171 unq 0 iso 0 dist 7.71426 5.93786 6.29877 5.48551 10.352 7.22518 8.1344 5.90358 3.98338 7.58499 numMergedOcc 0
26 mol 171 unq 1 iso 0 dist 7.71426 5.93786 6.29877 7.9651 11.4752 5.25109 8.1344 5.90358 3.98338 8.21618 numMergedOcc 0
27 mol 171 unq 2 iso 0 dist 7.71426 8.1344 5.90358 5.48551 10.352 7.58499 5.93786 6.29877 3.98338 7.22518 numMergedOcc 0
28 mol 171 unq 3 iso 0 dist 7.71426 8.1344 5.90358 7.9651 11.4752 8.21618 5.93786 6.29877 3.98338 5.25109 numMergedOcc 0
29 mol 171 unq 4 iso 0 dist 5.10618 8.24693 6.29877 8.05069 10.352 7.22518 6.71356 5.90358 3.98338 7.58499 numMergedOcc 0
30 mol 171 unq 5 iso 0 dist 5.10618 8.24693 6.29877 12.6853 11.4752 5.25109 6.71356 5.90358 3.98338 8.21618 numMergedOcc 0
31 mol 171 unq 6 iso 0 dist 5.10618 6.71356 5.90358 8.05069 10.352 7.58499 8.24693 6.29877 3.98338 7.22518 numMergedOcc 0
32 mol 171 unq 7 iso 0 dist 5.10618 6.71356 5.90358 12.6853 11.4752 8.21618 8.24693 6.29877 3.98338 5.25109 numMergedOcc 0
33 mol 192 unq 0 iso 0 dist 7.24199 8.77999 3.86183 12.717 10.3117 6.60053 17.9671 12.7433 9.52218 8.26288 numMergedOcc 0
34 mol 194 unq 0 iso 0 dist 6.26839 8.65535 5.92931 11.6598 5.68348 6.1886 12.4952 7.50057 9.4131 6.38324 numMergedOcc 0
35 mol 194 unq 1 iso 0 dist 8.83356 6.72379 7.50057 7.11753 5.68348 6.38324 12.645 5.92931 9.4131 6.1886 numMergedOcc 0
36 mol 232 unq 0 iso 0 dist 7.83711 9.05071 13.8622 4.9377 6.57921 9.8664 13.7227 7.86594 16.4381 9.78181 numMergedOcc 0
37 mol 274 unq 0 iso 0 dist 9.56685 9.85289 5.36428 5.29529 8.2997 6.88827 14.1515 14.986 11.6106 9.16942 numMergedOcc 0
38 mol 274 unq 1 iso 0 dist 8.49922 9.85289 11.9754 5.29529 10.4781 6.88827 14.1515 18.8429 11.6106 9.16942 numMergedOcc 0
