0 mol 7 unq 0 iso 0 dist 7.15434 7.29541 5.72491 8.75346 9.67164 8.0744 numMergedOcc 0
1 mol 9 unq 0 iso 0 dist 9.16444 6.84888 7.05346 6.92407 8.30653 4.3947 numMergedOcc 0
2 mol 18 unq 0 iso 0 dist 6.39243 6.43155 7.55766 4.95319 5.65084 4.8604 numMergedOcc 0
3 mol 18 unq 1 iso 0 dist 9.1715 10.2305 7.55766 6.19959 5.65084 4.8604 numMergedOcc 0
4 mol 24 unq 0 iso 0 dist 8.20058 12.1567 6.72502 12.0268 8.09311 9.94429 numMergedOcc 0
5 mol 24 unq 1 iso 0 dist 8.20058 12.1567 6.72502 9.10781 9.05357 6.88355 numMergedOcc 0
6 mol 25 unq 0 iso 0 dist 6.23095 6.06832 5.81959 11.9503 7.6114 11.4877 numMergedOcc 0
7 mol 43 unq 0 iso 0 dist 9.17086 8.33667 9.93832 4.9903 6.6263 4.55347 numMergedOcc 0
8 mol 56 unq 0 iso 0 dist 9.77018 7.79856 8.63486 12.6833 9.2898 15.8558 numMergedOcc 0
9 mol 56 unq 1 iso 0 dist 8.96238 6.5705 6.77886 12.9131 9.03564 10.5332 numMergedOcc 0
10 mol 73 unq 0 iso 0 dist 8.124 16.0036 8.73253 15.7072 8.68662 10.9746 numMergedOcc 0
11 mol 73 unq 1 iso 0 dist 8.124 16.0036 8.73253 15.2252 7.4369 7.8972 numMergedOcc 0
12 mol 73 unq 2 iso 0 dist 8.16299 11.9686 8.85586 6.52486 5.5087 5.50891 numMergedOcc 0
13 mol 73 unq 3 iso 0 dist 8.16299 11.9686 8.85586 10.9731 6.08682 4.75954 numMergedOcc 0
14 mol 73 unq 4 iso 0 dist 8.16299 11.4934 7.11 6.52486 5.5087 7.50869 numMergedOcc 0
15 mol 73 unq 5 iso 0 dist 8.16299 11.4934 7.11 10.9731 6.08682 3.6807 numMergedOcc 0
16 mol 73 unq 6 iso 0 dist 8.27015 16.4476 8.85586 13.0059 5.5087 5.50891 numMergedOcc 0
17 mol 73 unq 7 iso 0 dist 8.27015 16.4476 8.85586 14.1533 6.08682 4.75954 numMergedOcc 0
18 mol 73 unq 8 iso 0 dist 8.27015 14.727 7.11 13.0059 5.5087 7.50869 numMergedOcc 0
19 mol 73 unq 9 iso 0 dist 8.27015 14.727 7.11 14.1533 6.08682 3.6807 numMergedOcc 0
20 mol 76 unq 0 iso 0 dist 5.56964 8.88275 4.79949 6.65453 9.85905 11.0792 numMergedOcc 0
21 mol 76 unq 1 iso 0 dist 5.56964 7.18485 7.27693 6.65453 9.85905 6.48293 numMergedOcc 0
22 mol 100 unq 0 iso 0 dist 8.92577 9.57933 9.00544 10.5559 7.82475 11.3766 numMergedOcc 0
23 mol 100 unq 1 iso 0 dist 8.92577 9.57933 9.00544 11.1947 5.35782 10.5056 numMergedOcc 0
24 mol 100 unq 2 iso 0 dist 8.92577 7.04774 7.12017 10.5559 7.82475 13.4027 numMergedOcc 0
25 mol 100 unq 3 iso 0 dist 8.92577 7.04774 7.12017 11.1947 5.35782 12.068 numMergedOcc 0
26 mol 100 unq 4 iso 0 dist 9.56324 6.95888 9.00544 15.353 7.82475 11.3766 numMergedOcc 0
27 mol 100 unq 5 iso 0 dist 9.56324 6.95888 9.00544 12.9628 5.35782 10.5056 numMergedOcc 0
28 mol 100 unq 6 iso 0 dist 9.56324 10.3606 7.12017 15.353 7.82475 13.4027 numMergedOcc 0
29 mol 100 unq 7 iso 0 dist 9.56324 10.3606 7.12017 12.9628 5.35782 12.068 numMergedOcc 0
30 mol 109 unq 0 iso 0 dist 8.84523 9.01694 5.34214 10.5361 7.07971 6.8409 numMergedOcc 0
31 mol 119 unq 0 iso 0 dist 8.62648 8.9683 8.56342 12.6962 7.64052 6.29394 numMergedOcc 0
32 mol 119 unq 1 iso 0 dist 8.62648 5.50673 6.37542 12.6962 7.64052 9.64502 numMergedOcc 0
33 mol 131 unq 0 iso 0 dist 9.33945 11.8905 8.86329 9.88758 9.27976 5.30999 numMergedOcc 0
34 mol 141 unq 0 iso 0 dist 7.34465 7.97183 6.69515 11.1983 8.07097 5.25982 numMergedOcc 0
35 mol 159 unq 0 iso 0 dist 7.47975 9.78249 7.25742 7.21999 9.36259 5.34453 numMergedOcc 0
36 mol 195 unq 0 iso 0 dist 8.3705 9.80071 7.62942 4.29894 9.03441 8.89297 numMergedOcc 0
37 mol 218 unq 0 iso 0 dist 4.851 11.3699 9.20961 6.13691 6.67404 6.57708 numMergedOcc 0
38 mol 227 unq 0 iso 0 dist 9.60159 11.2986 8.38865 5.19262 5.23634 7.3164 numMergedOcc 0
39 mol 232 unq 0 iso 0 dist 9.95045 16.7146 7.83711 13.3209 6.71524 8.03712 numMergedOcc 0
40 mol 238 unq 0 iso 0 dist 8.96639 6.85179 6.4398 9.54858 8.82351 6.22195 numMergedOcc 0
41 mol 238 unq 1 iso 0 dist 9.38753 8.09178 5.52379 11.5133 9.07475 6.50998 numMergedOcc 0
42 mol 238 unq 2 iso 0 dist 9.38753 8.09178 5.52379 12.2802 6.99888 5.63944 numMergedOcc 0
43 mol 264 unq 0 iso 0 dist 6.8902 5.86656 6.14323 9.58347 8.29262 5.82131 numMergedOcc 0
