0 mol 9 unq 0 iso 0 dist 6.11048 5.67536 6.59312 10.9235 5.47 8.59513 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 8.14998 6.96891 6.59312 12.0338 5.47 8.59513 numMergedOcc 0
2 mol 17 unq 0 iso 0 dist 8.70792 4.03817 5.16502 9.79861 6.66983 8.26398 numMergedOcc 0
3 mol 18 unq 0 iso 0 dist 8.02753 5.32758 5.59658 10.0073 4.97344 7.94376 numMergedOcc 0
4 mol 24 unq 0 iso 0 dist 8.23075 5.11617 7.85986 4.7841 6.0925 4.30252 numMergedOcc 0
5 mol 24 unq 1 iso 0 dist 4.7841 4.50066 7.03544 9.52201 9.24588 6.93597 numMergedOcc 0
6 mol 24 unq 2 iso 0 dist 4.7841 5.11617 4.30252 8.23075 6.0925 7.85986 numMergedOcc 0
7 mol 48 unq 0 iso 0 dist 7.15542 8.82805 7.20729 14.4924 8.75789 7.84895 numMergedOcc 0
8 mol 48 unq 1 iso 0 dist 7.15542 8.82805 7.20729 13.602 8.74768 5.8541 numMergedOcc 0
9 mol 48 unq 2 iso 0 dist 7.15542 8.82805 7.20729 9.54465 8.79085 5.82264 numMergedOcc 0
10 mol 48 unq 3 iso 0 dist 7.15542 8.82805 7.20729 9.3774 4.52343 5.72703 numMergedOcc 0
11 mol 79 unq 0 iso 0 dist 5.25027 9.69296 7.56495 4.37025 5.30569 7.63923 numMergedOcc 0
12 mol 79 unq 1 iso 0 dist 5.25027 9.69296 7.56495 11.7031 7.28768 8.23095 numMergedOcc 0
13 mol 79 unq 2 iso 0 dist 4.37025 9.69296 7.63923 5.25027 5.30569 7.56495 numMergedOcc 0
14 mol 79 unq 3 iso 0 dist 4.37025 9.69296 7.63923 11.7031 8.91283 8.23095 numMergedOcc 0
15 mol 85 unq 0 iso 0 dist 7.69926 10.6804 9.13593 5.85237 2.58673 8.25144 numMergedOcc 0
16 mol 85 unq 1 iso 0 dist 5.85237 10.6804 8.25144 7.69926 2.58673 9.13593 numMergedOcc 0
17 mol 85 unq 2 iso 0 dist 9.11768 6.85929 8.25144 9.7173 2.58673 9.13593 numMergedOcc 0
18 mol 113 unq 0 iso 0 dist 9.59585 8.42718 5.35711 14.4591 7.41778 6.23759 numMergedOcc 0
19 mol 123 unq 0 iso 0 dist 8.111 14.0935 7.30244 12.3048 8.77423 9.42762 numMergedOcc 0
20 mol 147 unq 0 iso 0 dist 6.73617 8.93262 9.59327 9.03544 3.6066 8.51399 numMergedOcc 0
21 mol 147 unq 1 iso 0 dist 9.03544 8.93262 8.51399 6.73617 3.6066 9.59327 numMergedOcc 0
22 mol 168 unq 0 iso 0 dist 7.48734 11.7533 6.12453 11.0618 5.29906 9.87447 numMergedOcc 0
23 mol 168 unq 1 iso 0 dist 5.6125 7.32989 6.12453 10.3143 5.29906 9.87447 numMergedOcc 0
24 mol 169 unq 0 iso 0 dist 9.37946 8.6888 5.41121 14.7817 7.75905 6.35799 numMergedOcc 0
25 mol 253 unq 0 iso 0 dist 8.93741 6.0964 9.82605 11.3445 5.00013 9.73723 numMergedOcc 0
26 mol 258 unq 0 iso 0 dist 6.76495 4.66802 7.08328 12.1509 8.91869 8.31526 numMergedOcc 0
27 mol 258 unq 1 iso 0 dist 5.4557 6.93678 7.08328 11.3432 8.91869 8.31526 numMergedOcc 0
28 mol 275 unq 0 iso 0 dist 8.81644 4.33371 5.74353 13.3802 5.72232 9.68834 numMergedOcc 0
29 mol 281 unq 0 iso 0 dist 5.50053 11.6729 6.18742 7.33334 3.77058 6.8089 numMergedOcc 0
30 mol 281 unq 1 iso 0 dist 7.33334 11.6729 6.8089 5.50053 3.77058 6.18742 numMergedOcc 0
