0 mol 10 unq 0 iso 0 dist 8.44864 5.94361 5.59965 10.0703 7.8329 9.76721 numMergedOcc 0
1 mol 11 unq 0 iso 0 dist 9.78754 9.66474 7.98326 9.26728 9.81983 6.76736 numMergedOcc 0
2 mol 11 unq 1 iso 0 dist 9.78754 10.3999 7.90478 9.26728 9.81983 13.5186 numMergedOcc 0
3 mol 26 unq 0 iso 0 dist 8.99751 9.62452 7.35861 3.30063 9.82851 12.335 numMergedOcc 0
4 mol 26 unq 1 iso 0 dist 9.44507 14.288 6.56527 3.30063 9.11311 12.5394 numMergedOcc 0
5 mol 26 unq 2 iso 0 dist 9.30674 7.40218 7.35861 6.79894 9.82851 12.335 numMergedOcc 0
6 mol 26 unq 3 iso 0 dist 8.25567 3.9882 7.35861 10.8557 9.82851 12.335 numMergedOcc 0
7 mol 44 unq 0 iso 0 dist 9.45566 4.83412 7.48846 12.2887 6.53981 8.06674 numMergedOcc 0
8 mol 54 unq 0 iso 0 dist 4.38047 10.5895 9.17082 2.97898 5.27979 10.1434 numMergedOcc 0
9 mol 55 unq 0 iso 0 dist 6.66861 10.042 9.93096 6.77823 6.76315 3.56023 numMergedOcc 0
10 mol 55 unq 1 iso 0 dist 6.72084 12.1572 9.93096 8.80267 6.76315 3.56023 numMergedOcc 0
11 mol 79 unq 0 iso 0 dist 8.17655 4.32712 8.03296 8.65738 6.2576 6.07693 numMergedOcc 0
12 mol 79 unq 1 iso 0 dist 8.17655 11.1935 9.26979 8.65738 6.2576 5.25584 numMergedOcc 0
13 mol 79 unq 2 iso 0 dist 6.47416 4.32712 5.82754 8.65738 8.96069 6.07693 numMergedOcc 0
14 mol 79 unq 3 iso 0 dist 6.47416 11.1935 9.05679 8.65738 8.96069 5.25584 numMergedOcc 0
15 mol 79 unq 4 iso 0 dist 9.78129 6.04442 8.03296 7.3779 6.2576 6.07693 numMergedOcc 0
16 mol 79 unq 5 iso 0 dist 9.78129 11.2226 9.26979 7.3779 6.2576 5.25584 numMergedOcc 0
17 mol 91 unq 0 iso 0 dist 5.51406 10.4949 8.66165 8.88997 9.97813 5.21888 numMergedOcc 0
18 mol 92 unq 0 iso 0 dist 7.7913 11.9687 6.77241 14.5986 6.89071 8.93569 numMergedOcc 0
19 mol 92 unq 1 iso 0 dist 7.7913 12.841 5.50508 14.5986 6.89071 3.98877 numMergedOcc 0
20 mol 92 unq 2 iso 0 dist 7.11127 9.3668 5.50508 3.94069 8.4219 9.18008 numMergedOcc 0
21 mol 92 unq 3 iso 0 dist 6.37888 4.00884 5.50508 6.87448 8.4219 9.18008 numMergedOcc 0
22 mol 92 unq 4 iso 0 dist 7.11438 4.1125 5.50508 12.6706 8.4219 9.18008 numMergedOcc 0
23 mol 93 unq 0 iso 0 dist 7.4518 14.4094 8.89417 14.6061 7.83506 5.90646 numMergedOcc 0
24 mol 93 unq 1 iso 0 dist 7.4518 9.73718 9.95255 14.6061 7.83506 12.949 numMergedOcc 0
25 mol 113 unq 0 iso 0 dist 9.66068 14.6132 6.6317 3.74516 7.40338 13.2601 numMergedOcc 0
26 mol 119 unq 0 iso 0 dist 8.4733 5.73999 7.20249 3.80816 6.21165 5.77063 numMergedOcc 0
27 mol 184 unq 0 iso 0 dist 8.95598 12.4352 7.54099 9.10254 7.02762 4.12242 numMergedOcc 0
28 mol 237 unq 0 iso 0 dist 8.42502 3.96327 8.10254 3.78608 8.95332 5.18809 numMergedOcc 0
29 mol 244 unq 0 iso 0 dist 8.08939 8.89726 7.95359 15.1141 9.30179 8.74744 numMergedOcc 0
30 mol 244 unq 1 iso 0 dist 8.08939 8.89726 7.95359 3.62882 6.10489 5.98501 numMergedOcc 0
31 mol 244 unq 2 iso 0 dist 8.08939 8.89726 7.95359 7.8506 4.4204 5.00596 numMergedOcc 0
32 mol 244 unq 3 iso 0 dist 8.08939 10.6799 6.22122 15.1141 9.30179 13.2473 numMergedOcc 0
33 mol 244 unq 4 iso 0 dist 8.08939 10.6799 6.22122 3.62882 6.10489 10.1665 numMergedOcc 0
34 mol 244 unq 5 iso 0 dist 8.08939 10.6799 6.22122 7.8506 4.4204 5.68434 numMergedOcc 0
35 mol 244 unq 6 iso 0 dist 7.33574 4.55034 7.95359 12.1511 9.30179 8.74744 numMergedOcc 0
36 mol 244 unq 7 iso 0 dist 7.33574 4.55034 7.95359 5.2503 6.10489 5.98501 numMergedOcc 0
37 mol 244 unq 8 iso 0 dist 7.33574 4.55034 7.95359 3.66626 4.4204 5.00596 numMergedOcc 0
38 mol 244 unq 9 iso 0 dist 7.33574 8.05133 6.22122 12.1511 9.30179 13.2473 numMergedOcc 0
39 mol 244 unq 10 iso 0 dist 7.33574 8.05133 6.22122 5.2503 6.10489 10.1665 numMergedOcc 0
40 mol 244 unq 11 iso 0 dist 7.33574 8.05133 6.22122 3.66626 4.4204 5.68434 numMergedOcc 0
41 mol 249 unq 0 iso 0 dist 6.58109 6.02223 5.9627 14.8497 8.76518 11.2713 numMergedOcc 0
42 mol 260 unq 0 iso 0 dist 5.68717 7.55193 9.32954 3.48905 6.49413 4.07425 numMergedOcc 0
43 mol 260 unq 1 iso 0 dist 5.68717 7.55193 9.32954 3.43711 6.12343 9.82931 numMergedOcc 0
44 mol 260 unq 2 iso 0 dist 5.68717 7.55193 9.32954 8.84611 4.52405 9.36278 numMergedOcc 0
45 mol 273 unq 0 iso 0 dist 6.38341 7.55971 7.16346 10.2963 9.81919 9.84575 numMergedOcc 0
46 mol 287 unq 0 iso 0 dist 8.42076 5.89772 6.95912 9.03098 7.99204 5.75106 numMergedOcc 0
47 mol 288 unq 0 iso 0 dist 8.42076 5.89772 6.95912 9.03098 7.99204 5.75106 numMergedOcc 0
48 mol 289 unq 0 iso 0 dist 8.42076 5.89772 6.95912 9.03098 7.99204 5.75106 numMergedOcc 0
