0 mol 28 unq 0 iso 0 dist 7.32584 4.71641 9.05939 11.768 10.5266 8.24422 numMergedOcc 0
1 mol 28 unq 1 iso 0 dist 7.32584 7.5586 9.38747 11.768 10.5266 8.99724 numMergedOcc 0
2 mol 61 unq 0 iso 0 dist 9.2621 5.91456 7.97386 8.74608 6.20749 8.3814 numMergedOcc 0
3 mol 61 unq 1 iso 0 dist 8.74608 5.91456 8.3814 9.2621 6.20749 7.97386 numMergedOcc 0
4 mol 71 unq 0 iso 0 dist 8.25891 12.796 7.12853 12.0736 3.843 6.14513 numMergedOcc 0
5 mol 89 unq 0 iso 0 dist 6.78965 11.0394 6.86861 16.4145 11.2593 9.1784 numMergedOcc 0
6 mol 89 unq 1 iso 0 dist 7.45116 9.072 9.1784 10.8252 11.2593 6.86861 numMergedOcc 0
7 mol 98 unq 0 iso 0 dist 6.68748 5.68565 4.7588 10.0718 3.39244 7.14505 numMergedOcc 0
8 mol 99 unq 0 iso 0 dist 7.55911 13.3825 9.39801 11.3426 4.8794 6.02154 numMergedOcc 0
9 mol 99 unq 1 iso 0 dist 7.55911 6.06914 4.82346 11.3426 4.8794 8.07233 numMergedOcc 0
10 mol 104 unq 0 iso 0 dist 7.00359 5.30572 7.32917 9.41597 5.26833 8.84844 numMergedOcc 0
11 mol 104 unq 1 iso 0 dist 9.41597 5.30572 8.84844 7.00359 5.26833 7.32917 numMergedOcc 0
12 mol 118 unq 0 iso 0 dist 9.38422 7.42775 9.9757 9.53328 5.92414 9.4627 numMergedOcc 0
13 mol 118 unq 1 iso 0 dist 9.53328 7.42775 9.4627 9.38422 5.92414 9.9757 numMergedOcc 0
14 mol 173 unq 0 iso 0 dist 9.34814 9.25333 8.44321 16.0684 10.6362 8.32987 numMergedOcc 0
15 mol 220 unq 0 iso 0 dist 8.95183 6.54824 8.08702 13.2475 10.3111 9.984 numMergedOcc 0
16 mol 287 unq 0 iso 0 dist 9.13071 6.64598 9.30394 8.19596 6.60063 5.84467 numMergedOcc 0
17 mol 287 unq 1 iso 0 dist 9.13071 13.4002 8.5458 8.19596 6.60063 8.56533 numMergedOcc 0
18 mol 287 unq 2 iso 0 dist 8.19596 6.64598 5.84467 9.13071 6.60063 9.30394 numMergedOcc 0
19 mol 287 unq 3 iso 0 dist 8.19596 13.4002 8.56533 9.13071 6.60063 8.5458 numMergedOcc 0
20 mol 288 unq 0 iso 0 dist 9.13071 6.64598 9.30394 8.19596 6.60063 5.84467 numMergedOcc 0
21 mol 288 unq 1 iso 0 dist 9.13071 13.4002 8.5458 8.19596 6.60063 8.56533 numMergedOcc 0
22 mol 288 unq 2 iso 0 dist 8.19596 6.64598 5.84467 9.13071 6.60063 9.30394 numMergedOcc 0
23 mol 288 unq 3 iso 0 dist 8.19596 13.4002 8.56533 9.13071 6.60063 8.5458 numMergedOcc 0
24 mol 289 unq 0 iso 0 dist 9.13071 6.64598 9.30394 8.19596 6.60063 5.84467 numMergedOcc 0
25 mol 289 unq 1 iso 0 dist 9.13071 13.4002 8.5458 8.19596 6.60063 8.56533 numMergedOcc 0
26 mol 289 unq 2 iso 0 dist 8.19596 6.64598 5.84467 9.13071 6.60063 9.30394 numMergedOcc 0
27 mol 289 unq 3 iso 0 dist 8.19596 13.4002 8.56533 9.13071 6.60063 8.5458 numMergedOcc 0
