0 mol 26 unq 0 iso 0 dist 7.04707 11.7206 9.32718 12.9992 9.236 5.56687 numMergedOcc 0
1 mol 79 unq 0 iso 0 dist 8.40399 6.0425 9.78129 6.00684 4.25306 5.72627 numMergedOcc 0
2 mol 88 unq 0 iso 0 dist 5.59846 4.20309 6.85867 11.3997 9.40927 8.20319 numMergedOcc 0
3 mol 93 unq 0 iso 0 dist 8.52947 14.4934 7.4518 21.5766 13.8263 9.52206 numMergedOcc 0
4 mol 93 unq 1 iso 0 dist 8.52947 14.4934 7.4518 10.6424 4.1947 8.69945 numMergedOcc 0
5 mol 93 unq 2 iso 0 dist 8.52947 11.7807 9.1687 16.4618 9.45097 8.77074 numMergedOcc 0
6 mol 93 unq 3 iso 0 dist 8.84466 16.0131 7.4518 20.0751 13.8263 9.52206 numMergedOcc 0
7 mol 93 unq 4 iso 0 dist 8.84466 16.0131 7.4518 9.1246 4.1947 8.69945 numMergedOcc 0
8 mol 93 unq 5 iso 0 dist 8.84466 11.7408 9.1687 11.555 9.45097 8.77074 numMergedOcc 0
9 mol 128 unq 0 iso 0 dist 9.35162 7.34304 6.03154 6.49794 7.5191 8.73383 numMergedOcc 0
10 mol 173 unq 0 iso 0 dist 9.99743 12.1363 9.51638 12.8305 5.64974 8.14167 numMergedOcc 0
11 mol 181 unq 0 iso 0 dist 8.94464 6.15536 9.07527 10.6164 12.93 9.2933 numMergedOcc 0
12 mol 236 unq 0 iso 0 dist 5.92025 12.8555 8.37813 7.61854 4.24722 5.91739 numMergedOcc 0
13 mol 243 unq 0 iso 0 dist 8.93292 4.35114 8.55613 8.60091 6.42012 9.18477 numMergedOcc 0
14 mol 258 unq 0 iso 0 dist 8.62592 12.2121 8.63176 16.0886 10.9747 7.87648 numMergedOcc 0
15 mol 268 unq 0 iso 0 dist 9.7384 8.90545 8.6745 11.3151 10.5447 6.68794 numMergedOcc 0
