0 mol 9 unq 0 iso 0 dist 6.59455 8.55446 6.04312 13.7528 7.35972 10.6897 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 6.59455 5.71201 6.17866 13.7528 7.35972 12.3519 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 9.69752 9.36461 10.2653 11.9395 8.00171 6.72323 numMergedOcc 0
3 mol 24 unq 1 iso 0 dist 4.90592 8.16324 9.62033 10.0715 6.72323 15.7523 numMergedOcc 0
4 mol 24 unq 2 iso 0 dist 9.36461 9.69752 10.2653 11.9395 6.72323 8.00171 numMergedOcc 0
5 mol 30 unq 0 iso 0 dist 6.55815 7.09121 7.04792 5.60789 7.14464 11.3342 numMergedOcc 0
6 mol 44 unq 0 iso 0 dist 7.03307 7.25707 5.25016 5.1728 7.48846 10.3462 numMergedOcc 0
7 mol 131 unq 0 iso 0 dist 8.92828 5.56627 5.37172 11.6708 5.87084 10.1472 numMergedOcc 0
8 mol 131 unq 1 iso 0 dist 5.44303 8.50562 5.37172 5.66194 5.87084 10.1472 numMergedOcc 0
9 mol 141 unq 0 iso 0 dist 9.78667 6.73983 6.33946 8.69924 9.83945 6.75376 numMergedOcc 0
10 mol 141 unq 1 iso 0 dist 9.78667 7.64956 12.8394 8.69924 9.83945 9.10042 numMergedOcc 0
11 mol 141 unq 2 iso 0 dist 8.47026 8.6387 6.33946 9.33878 9.83945 6.75376 numMergedOcc 0
12 mol 141 unq 3 iso 0 dist 6.73983 9.78667 6.33946 8.69924 6.75376 9.83945 numMergedOcc 0
13 mol 141 unq 4 iso 0 dist 6.73983 7.64956 6.59975 8.69924 6.75376 9.10042 numMergedOcc 0
14 mol 141 unq 5 iso 0 dist 8.6387 8.47026 6.33946 9.33878 6.75376 9.83945 numMergedOcc 0
15 mol 141 unq 6 iso 0 dist 7.64956 9.78667 12.8394 8.69924 9.10042 9.83945 numMergedOcc 0
16 mol 141 unq 7 iso 0 dist 7.64956 9.78667 12.8394 9.41497 9.75059 13.9532 numMergedOcc 0
17 mol 141 unq 8 iso 0 dist 7.64956 9.78667 12.8394 9.53115 6.83404 18.1026 numMergedOcc 0
18 mol 141 unq 9 iso 0 dist 7.64956 6.73983 6.59975 8.69924 9.10042 6.75376 numMergedOcc 0
19 mol 141 unq 10 iso 0 dist 7.64956 6.73983 6.59975 9.41497 9.75059 10.215 numMergedOcc 0
20 mol 141 unq 11 iso 0 dist 7.64956 6.73983 6.59975 9.53115 6.83404 12.514 numMergedOcc 0
21 mol 141 unq 12 iso 0 dist 4.46777 6.94988 6.51325 5.38571 6.83404 11.8798 numMergedOcc 0
22 mol 193 unq 0 iso 0 dist 7.8141 8.43187 12.9373 3.98356 9.40801 11.3198 numMergedOcc 0
23 mol 225 unq 0 iso 0 dist 9.23935 7.77552 4.23863 8.98957 8.37739 9.47237 numMergedOcc 0
24 mol 225 unq 1 iso 0 dist 7.77552 9.23935 4.23863 8.98957 9.47237 8.37739 numMergedOcc 0
25 mol 226 unq 0 iso 0 dist 6.26945 6.37744 9.75764 6.85639 5.70795 10.3013 numMergedOcc 0
26 mol 232 unq 0 iso 0 dist 8.28466 7.38566 5.77703 12.721 9.8664 15.0843 numMergedOcc 0
27 mol 237 unq 0 iso 0 dist 5.06628 6.07878 8.65228 5.90415 8.10254 10.726 numMergedOcc 0
28 mol 237 unq 1 iso 0 dist 5.06628 7.80422 6.60537 5.90415 8.10254 11.6573 numMergedOcc 0
29 mol 237 unq 2 iso 0 dist 9.54499 9.36216 6.08027 9.25593 8.10254 12.2998 numMergedOcc 0
30 mol 237 unq 3 iso 0 dist 5.6703 8.72819 6.08027 6.26206 8.10254 12.2998 numMergedOcc 0
