0 mol 4 unq 0 iso 0 dist 9.15878 7.17837 9.63758 12.7019 5.39008 10.7798 numMergedOcc 0
1 mol 29 unq 0 iso 0 dist 9.99467 5.97548 5.36278 5.28538 8.53135 6.69806 numMergedOcc 0
2 mol 29 unq 1 iso 0 dist 9.99467 9.88128 7.50258 5.28538 8.53135 5.82508 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 9.76585 6.95983 8.84944 14.0003 7.67459 11.3412 numMergedOcc 0
4 mol 43 unq 1 iso 0 dist 9.76585 11.3999 7.21995 14.0003 7.67459 5.88097 numMergedOcc 0
5 mol 48 unq 0 iso 0 dist 9.04514 9.66389 5.35252 7.35749 9.79657 10.6637 numMergedOcc 0
6 mol 54 unq 0 iso 0 dist 9.70196 4.64745 8.16246 9.11627 6.29755 10.4221 numMergedOcc 0
7 mol 54 unq 1 iso 0 dist 9.25341 4.64745 9.48823 9.11627 7.4038 10.4221 numMergedOcc 0
8 mol 55 unq 0 iso 0 dist 8.95571 11.806 9.24055 10.0549 9.34552 12.3514 numMergedOcc 0
9 mol 55 unq 1 iso 0 dist 8.95571 12.3757 9.66898 10.0549 9.34552 7.15478 numMergedOcc 0
10 mol 61 unq 0 iso 0 dist 7.94667 9.38462 9.04549 5.19953 7.97386 5.85694 numMergedOcc 0
11 mol 61 unq 1 iso 0 dist 7.94667 9.38462 9.04549 9.4996 8.3814 9.84981 numMergedOcc 0
12 mol 61 unq 2 iso 0 dist 7.94667 4.09314 7.11706 5.19953 7.97386 5.50809 numMergedOcc 0
13 mol 61 unq 3 iso 0 dist 7.94667 4.09314 7.11706 9.4996 8.3814 6.58099 numMergedOcc 0
14 mol 67 unq 0 iso 0 dist 8.62244 10.5984 7.15248 7.5068 9.8048 12.8718 numMergedOcc 0
15 mol 67 unq 1 iso 0 dist 8.62244 9.67456 8.43162 7.5068 9.8048 9.08666 numMergedOcc 0
16 mol 73 unq 0 iso 0 dist 8.73093 12.3943 7.48556 8.84457 8.08507 15.0455 numMergedOcc 0
17 mol 73 unq 1 iso 0 dist 8.02104 9.57143 7.48556 10.8656 8.08507 15.0455 numMergedOcc 0
18 mol 76 unq 0 iso 0 dist 8.92491 8.04327 5.73235 9.81264 9.26231 10.2556 numMergedOcc 0
19 mol 76 unq 1 iso 0 dist 8.92491 14.685 7.48127 9.81264 9.26231 8.90561 numMergedOcc 0
20 mol 76 unq 2 iso 0 dist 7.41861 7.7047 5.73235 7.01534 9.26231 10.2556 numMergedOcc 0
21 mol 76 unq 3 iso 0 dist 7.41861 4.00834 7.48127 7.01534 9.26231 8.90561 numMergedOcc 0
22 mol 83 unq 0 iso 0 dist 6.77845 9.39588 7.2118 5.83828 7.9309 9.9201 numMergedOcc 0
23 mol 83 unq 1 iso 0 dist 5.48555 12.0034 7.2118 7.62986 7.9309 9.9201 numMergedOcc 0
24 mol 83 unq 2 iso 0 dist 5.39805 6.61275 7.2118 3.52321 7.9309 9.9201 numMergedOcc 0
25 mol 98 unq 0 iso 0 dist 7.70808 5.7618 6.30896 10.2351 5.26536 5.45089 numMergedOcc 0
26 mol 99 unq 0 iso 0 dist 5.61946 6.02095 8.68674 5.36117 4.82346 8.61334 numMergedOcc 0
27 mol 99 unq 1 iso 0 dist 5.61946 6.02095 8.68674 7.21001 8.07233 12.2155 numMergedOcc 0
28 mol 103 unq 0 iso 0 dist 8.75165 7.3651 6.79959 13.9402 8.88401 10.503 numMergedOcc 0
29 mol 128 unq 0 iso 0 dist 8.83811 12.0212 8.64054 6.41259 6.93718 6.95591 numMergedOcc 0
30 mol 133 unq 0 iso 0 dist 9.56319 14.3149 8.8353 6.70307 5.92836 7.82218 numMergedOcc 0
31 mol 133 unq 1 iso 0 dist 9.73038 17.9749 8.8353 12.974 5.92836 7.82218 numMergedOcc 0
32 mol 152 unq 0 iso 0 dist 9.66811 7.14779 9.65031 6.72526 9.27341 12.1354 numMergedOcc 0
33 mol 152 unq 1 iso 0 dist 9.66811 9.85198 8.51844 6.72526 9.27341 6.67687 numMergedOcc 0
34 mol 154 unq 0 iso 0 dist 9.87968 12.0865 8.66733 6.21365 6.95133 6.13253 numMergedOcc 0
35 mol 158 unq 0 iso 0 dist 8.80952 11.2678 9.96635 9.41162 8.95432 17.5374 numMergedOcc 0
36 mol 183 unq 0 iso 0 dist 6.0782 5.66126 8.97652 7.60712 9.84649 4.92164 numMergedOcc 0
37 mol 186 unq 0 iso 0 dist 6.36789 12.6035 6.72718 9.85164 9.60838 11.315 numMergedOcc 0
38 mol 192 unq 0 iso 0 dist 9.78743 13.2525 6.2016 9.99333 5.83093 6.16078 numMergedOcc 0
39 mol 205 unq 0 iso 0 dist 8.47833 11.2438 6.43519 9.61557 8.27071 5.07259 numMergedOcc 0
40 mol 205 unq 1 iso 0 dist 5.47586 7.47443 6.43519 7.43264 8.27071 5.07259 numMergedOcc 0
41 mol 239 unq 0 iso 0 dist 4.53228 10.9464 8.26312 4.53635 7.10828 13.8702 numMergedOcc 0
42 mol 239 unq 1 iso 0 dist 4.53228 6.54316 7.58554 4.53635 7.10828 8.46058 numMergedOcc 0
43 mol 239 unq 2 iso 0 dist 8.54078 10.4394 8.26312 9.93977 7.10828 13.8702 numMergedOcc 0
44 mol 239 unq 3 iso 0 dist 8.54078 6.2497 7.58554 9.93977 7.10828 8.46058 numMergedOcc 0
45 mol 250 unq 0 iso 0 dist 9.88044 7.15398 8.51703 6.8934 8.59384 11.6337 numMergedOcc 0
46 mol 250 unq 1 iso 0 dist 9.88044 6.13352 5.07895 6.8934 8.59384 5.95822 numMergedOcc 0
47 mol 271 unq 0 iso 0 dist 6.96986 12.846 9.50884 5.03107 5.76281 7.94329 numMergedOcc 0
48 mol 287 unq 0 iso 0 dist 6.19545 5.27724 5.15923 10.5258 9.30394 11.7624 numMergedOcc 0
49 mol 287 unq 1 iso 0 dist 6.19545 5.27724 5.15923 5.45438 5.84467 5.58788 numMergedOcc 0
50 mol 287 unq 2 iso 0 dist 7.3388 5.66584 6.96774 10.5636 9.84741 7.43524 numMergedOcc 0
51 mol 287 unq 3 iso 0 dist 6.96248 5.66584 7.14859 10.5258 8.5458 14.0575 numMergedOcc 0
52 mol 287 unq 4 iso 0 dist 6.96248 5.66584 7.14859 5.45438 8.56533 10.6005 numMergedOcc 0
53 mol 288 unq 0 iso 0 dist 6.19545 5.27724 5.15923 10.5258 9.30394 11.7624 numMergedOcc 0
54 mol 288 unq 1 iso 0 dist 6.19545 5.27724 5.15923 5.45438 5.84467 5.58788 numMergedOcc 0
55 mol 288 unq 2 iso 0 dist 7.3388 5.66584 6.96774 10.5636 9.84741 7.43524 numMergedOcc 0
56 mol 288 unq 3 iso 0 dist 6.96248 5.66584 7.14859 10.5258 8.5458 14.0575 numMergedOcc 0
57 mol 288 unq 4 iso 0 dist 6.96248 5.66584 7.14859 5.45438 8.56533 10.6005 numMergedOcc 0
58 mol 289 unq 0 iso 0 dist 6.19545 5.27724 5.15923 10.5258 9.30394 11.7624 numMergedOcc 0
59 mol 289 unq 1 iso 0 dist 6.19545 5.27724 5.15923 5.45438 5.84467 5.58788 numMergedOcc 0
60 mol 289 unq 2 iso 0 dist 7.3388 5.66584 6.96774 10.5636 9.84741 7.43524 numMergedOcc 0
61 mol 289 unq 3 iso 0 dist 6.96248 5.66584 7.14859 10.5258 8.5458 14.0575 numMergedOcc 0
62 mol 289 unq 4 iso 0 dist 6.96248 5.66584 7.14859 5.45438 8.56533 10.6005 numMergedOcc 0
63 mol 294 unq 0 iso 0 dist 9.4943 5.71611 6.37998 8.68925 8.46311 9.503 numMergedOcc 0
64 mol 294 unq 1 iso 0 dist 9.4943 7.88101 9.77023 8.68925 8.46311 14.1763 numMergedOcc 0
