0 mol 54 unq 0 iso 0 dist 8.53459 4.70344 5.53875 14.4548 8.83986 9.77131 numMergedOcc 0
1 mol 59 unq 0 iso 0 dist 8.26423 8.344 9.20253 11.4521 7.07517 8.10708 numMergedOcc 0
2 mol 59 unq 1 iso 0 dist 8.26423 8.344 9.20253 11.4788 6.59689 8.42956 numMergedOcc 0
3 mol 59 unq 2 iso 0 dist 8.82919 17.4568 9.20253 12.9141 7.07517 8.10708 numMergedOcc 0
4 mol 59 unq 3 iso 0 dist 8.82919 17.4568 9.20253 14.806 6.59689 8.42956 numMergedOcc 0
5 mol 68 unq 0 iso 0 dist 5.68303 4.55484 8.18002 10.4048 11.2311 9.01261 numMergedOcc 0
6 mol 75 unq 0 iso 0 dist 6.76977 8.67697 7.14313 15.3947 11.6648 8.26819 numMergedOcc 0
7 mol 127 unq 0 iso 0 dist 7.88328 4.95538 5.45159 5.33851 5.46468 4.9835 numMergedOcc 0
8 mol 127 unq 1 iso 0 dist 5.33851 4.95538 4.9835 7.88328 5.46468 5.45159 numMergedOcc 0
9 mol 130 unq 0 iso 0 dist 9.9205 16.8042 8.98551 14.4723 8.39466 8.67153 numMergedOcc 0
10 mol 143 unq 0 iso 0 dist 7.88346 9.73727 8.57285 12.1627 15.1779 8.22353 numMergedOcc 0
11 mol 186 unq 0 iso 0 dist 7.78385 11.8686 5.80433 13.647 5.95728 6.49786 numMergedOcc 0
12 mol 186 unq 1 iso 0 dist 7.78385 12.0698 6.8285 13.647 5.95728 8.43154 numMergedOcc 0
13 mol 186 unq 2 iso 0 dist 7.17789 12.8874 5.80433 11.5225 5.95728 6.49786 numMergedOcc 0
14 mol 186 unq 3 iso 0 dist 7.17789 12.3457 6.8285 11.5225 5.95728 8.43154 numMergedOcc 0
15 mol 187 unq 0 iso 0 dist 8.71134 5.83106 8.9148 13.0026 12.8195 7.9625 numMergedOcc 0
16 mol 228 unq 0 iso 0 dist 8.53297 13.1757 7.81837 20.3685 15.9067 8.10816 numMergedOcc 0
17 mol 228 unq 1 iso 0 dist 9.23333 13.0333 7.81837 19.8415 15.9067 8.10816 numMergedOcc 0
18 mol 228 unq 2 iso 0 dist 7.24491 8.00573 7.81837 14.5761 15.9067 8.10816 numMergedOcc 0
19 mol 228 unq 3 iso 0 dist 6.02491 5.55391 7.81837 12.679 15.9067 8.10816 numMergedOcc 0
20 mol 228 unq 4 iso 0 dist 9.21065 12.8284 7.97746 19.6537 15.904 7.95486 numMergedOcc 0
21 mol 228 unq 5 iso 0 dist 7.65917 7.6598 7.97746 14.0476 15.904 7.95486 numMergedOcc 0
22 mol 228 unq 6 iso 0 dist 5.89577 5.86537 7.97746 12.8445 15.904 7.95486 numMergedOcc 0
23 mol 228 unq 7 iso 0 dist 8.6694 13.673 7.97746 20.5962 15.904 7.95486 numMergedOcc 0
24 mol 287 unq 0 iso 0 dist 5.96033 8.6202 8.40198 13.3032 8.53973 9.11967 numMergedOcc 0
25 mol 288 unq 0 iso 0 dist 5.96033 8.6202 8.40198 13.3032 8.53973 9.11967 numMergedOcc 0
26 mol 289 unq 0 iso 0 dist 5.96033 8.6202 8.40198 13.3032 8.53973 9.11967 numMergedOcc 0
