0 mol 7 unq 0 iso 0 dist 9.26914 5.47645 9.8603 18.2699 9.67164 16.6461 numMergedOcc 0
1 mol 69 unq 0 iso 0 dist 8.59353 14.5928 9.8809 13.914 6.9362 4.69809 numMergedOcc 0
2 mol 76 unq 0 iso 0 dist 9.19402 12.8409 8.09199 15.1746 9.13322 5.37642 numMergedOcc 0
3 mol 76 unq 1 iso 0 dist 9.19402 6.03473 7.47794 15.1746 9.13322 12.1618 numMergedOcc 0
4 mol 78 unq 0 iso 0 dist 9.80802 7.75819 9.23023 9.93158 6.85523 13.8703 numMergedOcc 0
5 mol 78 unq 1 iso 0 dist 9.80802 7.75819 9.23023 11.5941 5.77326 11.9719 numMergedOcc 0
6 mol 88 unq 0 iso 0 dist 6.89004 6.02891 9.72689 4.02602 7.80898 10.0429 numMergedOcc 0
7 mol 88 unq 1 iso 0 dist 6.89004 11.5666 7.74197 4.02602 7.80898 11.151 numMergedOcc 0
8 mol 109 unq 0 iso 0 dist 5.8729 14.1026 8.3164 10.2645 7.07971 8.08642 numMergedOcc 0
9 mol 122 unq 0 iso 0 dist 5.94669 7.56329 6.78949 8.30405 6.00603 4.78332 numMergedOcc 0
10 mol 122 unq 1 iso 0 dist 5.94669 5.85988 9.40018 8.30405 6.00603 12.4857 numMergedOcc 0
11 mol 133 unq 0 iso 0 dist 6.2109 9.61802 5.82404 6.10716 8.77023 11.5628 numMergedOcc 0
12 mol 197 unq 0 iso 0 dist 9.24777 8.64161 8.3337 15.546 9.10817 17.2264 numMergedOcc 0
13 mol 197 unq 1 iso 0 dist 9.24777 8.64161 8.3337 9.12935 9.73548 5.5875 numMergedOcc 0
14 mol 205 unq 0 iso 0 dist 6.40983 6.67855 5.96555 10.418 6.52816 6.96644 numMergedOcc 0
15 mol 259 unq 0 iso 0 dist 9.07855 10.6732 9.54857 11.2726 5.85442 5.49348 numMergedOcc 0
16 mol 259 unq 1 iso 0 dist 9.07855 10.6732 9.54857 9.26271 6.95511 5.13138 numMergedOcc 0
17 mol 277 unq 0 iso 0 dist 8.61945 16.0735 9.29635 12.6855 9.35539 12.7269 numMergedOcc 0
18 mol 277 unq 1 iso 0 dist 8.61945 16.0735 9.29635 15.9144 8.9682 12.2421 numMergedOcc 0
19 mol 277 unq 2 iso 0 dist 8.61945 16.0735 9.29635 13.156 6.92711 10.9521 numMergedOcc 0
