0 mol 4 unq 0 iso 0 dist 6.22303 5.13908 8.7041 7.02225 5.79308 5.31026 numMergedOcc 0
1 mol 7 unq 0 iso 0 dist 9.8592 7.91041 9.67498 15.2778 10.2939 8.85869 numMergedOcc 0
2 mol 8 unq 0 iso 0 dist 9.73496 5.53899 9.36839 14.1298 11.4319 9.83409 numMergedOcc 0
3 mol 55 unq 0 iso 0 dist 5.29239 6.19827 7.58788 8.67161 6.63489 5.62629 numMergedOcc 0
4 mol 55 unq 1 iso 0 dist 5.29239 6.19827 7.58788 8.87902 6.37473 6.15118 numMergedOcc 0
5 mol 61 unq 0 iso 0 dist 7.96502 5.25196 8.30431 13.9782 16.966 9.94756 numMergedOcc 0
6 mol 61 unq 1 iso 0 dist 7.96502 6.97911 4.628 11.228 4.71793 6.85094 numMergedOcc 0
7 mol 69 unq 0 iso 0 dist 9.16791 15.4318 7.09393 14.708 8.50938 8.51894 numMergedOcc 0
8 mol 69 unq 1 iso 0 dist 9.16791 11.6163 3.87167 14.708 8.50938 8.27592 numMergedOcc 0
9 mol 114 unq 0 iso 0 dist 6.15949 5.67441 5.31281 5.37661 7.22809 8.592 numMergedOcc 0
10 mol 151 unq 0 iso 0 dist 8.54771 4.76145 8.40442 10.6995 10.5699 6.12385 numMergedOcc 0
11 mol 165 unq 0 iso 0 dist 9.76113 10.2845 8.64349 13.3119 5.89709 6.31455 numMergedOcc 0
12 mol 178 unq 0 iso 0 dist 9.3355 5.50567 6.25455 7.24761 6.33374 7.82796 numMergedOcc 0
13 mol 181 unq 0 iso 0 dist 9.614 9.24302 8.78709 13.8382 11.6119 5.77393 numMergedOcc 0
14 mol 199 unq 0 iso 0 dist 7.22303 10.5991 9.56785 14.9679 10.1856 8.27889 numMergedOcc 0
15 mol 206 unq 0 iso 0 dist 7.53036 8.8592 8.93927 11.3092 15.2726 7.4732 numMergedOcc 0
16 mol 220 unq 0 iso 0 dist 5.99718 9.55761 8.23246 9.95731 4.80815 7.0166 numMergedOcc 0
17 mol 220 unq 1 iso 0 dist 5.60195 8.66923 7.86207 14.0757 11.9931 8.58709 numMergedOcc 0
18 mol 220 unq 2 iso 0 dist 7.87359 5.3178 7.86207 12.0636 11.9931 8.58709 numMergedOcc 0
19 mol 226 unq 0 iso 0 dist 6.3687 12.3798 7.20862 21.12 15.6116 9.05082 numMergedOcc 0
20 mol 261 unq 0 iso 0 dist 8.36611 5.10045 6.41477 13.0824 5.72823 9.56414 numMergedOcc 0
21 mol 261 unq 1 iso 0 dist 8.36611 5.10045 6.41477 13.9104 9.836 9.64886 numMergedOcc 0
22 mol 280 unq 0 iso 0 dist 4.55639 7.07259 6.83927 7.53963 6.12141 9.047 numMergedOcc 0
23 mol 280 unq 1 iso 0 dist 7.72152 10.1323 6.83927 13.1013 6.12141 9.047 numMergedOcc 0
24 mol 287 unq 0 iso 0 dist 8.80626 10.6818 4.49185 18.8813 10.3833 8.83885 numMergedOcc 0
25 mol 288 unq 0 iso 0 dist 8.80626 10.6818 4.49185 18.8813 10.3833 8.83885 numMergedOcc 0
26 mol 289 unq 0 iso 0 dist 8.80626 10.6818 4.49185 18.8813 10.3833 8.83885 numMergedOcc 0
