0 mol 8 unq 0 iso 0 dist 8.68949 9.31461 3.84732 6.04779 7.74386 10.5793 numMergedOcc 0
1 mol 33 unq 0 iso 0 dist 8.04019 6.53195 7.85245 6.90464 8.0346 10.5482 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 7.21995 8.81562 3.83842 5.88097 7.67459 7.80117 numMergedOcc 0
3 mol 48 unq 0 iso 0 dist 5.35252 7.99434 6.44604 10.6637 9.79657 12.1193 numMergedOcc 0
4 mol 61 unq 0 iso 0 dist 7.11706 9.0681 3.80737 5.50809 7.97386 11.441 numMergedOcc 0
5 mol 61 unq 1 iso 0 dist 7.11706 9.0681 3.80737 6.58099 8.3814 11.05 numMergedOcc 0
6 mol 76 unq 0 iso 0 dist 7.48127 5.91098 8.58474 8.90561 9.26231 13.1652 numMergedOcc 0
7 mol 83 unq 0 iso 0 dist 7.2118 7.69755 4.48523 9.9201 7.9309 12.2134 numMergedOcc 0
8 mol 90 unq 0 iso 0 dist 9.06641 8.63446 6.65219 6.3566 7.94379 8.96446 numMergedOcc 0
9 mol 124 unq 0 iso 0 dist 7.18976 8.50362 5.3096 9.2094 8.03603 9.66083 numMergedOcc 0
10 mol 186 unq 0 iso 0 dist 6.72718 9.12589 9.57585 11.315 9.60838 18.1267 numMergedOcc 0
11 mol 204 unq 0 iso 0 dist 9.52029 9.41594 9.47121 13.8486 9.23669 16.3442 numMergedOcc 0
12 mol 204 unq 1 iso 0 dist 9.52029 9.92651 11.8097 13.8486 9.23669 19.7988 numMergedOcc 0
13 mol 205 unq 0 iso 0 dist 4.81837 8.83628 9.70513 6.25023 7.25362 14.3028 numMergedOcc 0
14 mol 205 unq 1 iso 0 dist 6.43519 8.83628 6.82382 5.07259 8.27071 11.5105 numMergedOcc 0
15 mol 210 unq 0 iso 0 dist 8.05949 7.95917 4.68656 11.5037 8.50367 12.8375 numMergedOcc 0
16 mol 210 unq 1 iso 0 dist 8.05949 7.95917 4.68656 15.7959 8.94889 13.2134 numMergedOcc 0
17 mol 228 unq 0 iso 0 dist 9.9685 6.72203 10.7078 7.17017 8.22515 12.3934 numMergedOcc 0
18 mol 239 unq 0 iso 0 dist 9.01071 7.24545 7.17772 13.3781 7.449 13.9855 numMergedOcc 0
19 mol 239 unq 1 iso 0 dist 9.01071 7.24545 7.17772 14.2324 8.98789 13.8069 numMergedOcc 0
20 mol 239 unq 2 iso 0 dist 8.86185 7.24545 13.8399 10.1043 7.80073 14.9396 numMergedOcc 0
21 mol 244 unq 0 iso 0 dist 7.79787 9.3491 6.88123 8.64762 6.2667 11.2765 numMergedOcc 0
22 mol 249 unq 0 iso 0 dist 3.67935 6.62413 4.49386 6.13333 5.70674 5.7671 numMergedOcc 0
23 mol 254 unq 0 iso 0 dist 9.54511 5.83039 5.9731 9.66767 5.73448 9.47133 numMergedOcc 0
24 mol 254 unq 1 iso 0 dist 9.54511 6.74364 3.69576 9.66767 5.73448 7.61537 numMergedOcc 0
25 mol 273 unq 0 iso 0 dist 5.78262 8.13393 8.94124 7.01631 7.84151 14.0583 numMergedOcc 0
26 mol 273 unq 1 iso 0 dist 5.78262 8.13393 8.94124 7.05181 7.346 14.159 numMergedOcc 0
27 mol 287 unq 0 iso 0 dist 5.15923 9.77996 8.69518 11.7624 9.30394 13.733 numMergedOcc 0
28 mol 287 unq 1 iso 0 dist 5.15923 9.77996 8.69518 5.58788 5.84467 11.269 numMergedOcc 0
29 mol 287 unq 2 iso 0 dist 5.15923 6.61308 4.11753 11.7624 9.30394 11.068 numMergedOcc 0
30 mol 287 unq 3 iso 0 dist 5.15923 6.61308 4.11753 5.58788 5.84467 8.09613 numMergedOcc 0
31 mol 287 unq 4 iso 0 dist 5.15923 6.25845 4.00861 11.7624 9.30394 12.5897 numMergedOcc 0
32 mol 287 unq 5 iso 0 dist 5.15923 6.25845 4.00861 5.58788 5.84467 8.7503 numMergedOcc 0
33 mol 287 unq 6 iso 0 dist 6.96774 9.31611 5.03775 7.43524 9.84741 11.7353 numMergedOcc 0
34 mol 287 unq 7 iso 0 dist 7.14859 9.31611 8.95194 14.0575 8.5458 12.5897 numMergedOcc 0
35 mol 287 unq 8 iso 0 dist 7.14859 9.31611 8.95194 10.6005 8.56533 8.7503 numMergedOcc 0
36 mol 288 unq 0 iso 0 dist 5.15923 9.77996 8.69518 11.7624 9.30394 13.733 numMergedOcc 0
37 mol 288 unq 1 iso 0 dist 5.15923 9.77996 8.69518 5.58788 5.84467 11.269 numMergedOcc 0
38 mol 288 unq 2 iso 0 dist 5.15923 6.61308 4.11753 11.7624 9.30394 11.068 numMergedOcc 0
39 mol 288 unq 3 iso 0 dist 5.15923 6.61308 4.11753 5.58788 5.84467 8.09613 numMergedOcc 0
40 mol 288 unq 4 iso 0 dist 5.15923 6.25845 4.00861 11.7624 9.30394 12.5897 numMergedOcc 0
41 mol 288 unq 5 iso 0 dist 5.15923 6.25845 4.00861 5.58788 5.84467 8.7503 numMergedOcc 0
42 mol 288 unq 6 iso 0 dist 6.96774 9.31611 5.03775 7.43524 9.84741 11.7353 numMergedOcc 0
43 mol 288 unq 7 iso 0 dist 7.14859 9.31611 8.95194 14.0575 8.5458 12.5897 numMergedOcc 0
44 mol 288 unq 8 iso 0 dist 7.14859 9.31611 8.95194 10.6005 8.56533 8.7503 numMergedOcc 0
45 mol 289 unq 0 iso 0 dist 5.15923 9.77996 8.69518 11.7624 9.30394 13.733 numMergedOcc 0
46 mol 289 unq 1 iso 0 dist 5.15923 9.77996 8.69518 5.58788 5.84467 11.269 numMergedOcc 0
47 mol 289 unq 2 iso 0 dist 5.15923 6.61308 4.11753 11.7624 9.30394 11.068 numMergedOcc 0
48 mol 289 unq 3 iso 0 dist 5.15923 6.61308 4.11753 5.58788 5.84467 8.09613 numMergedOcc 0
49 mol 289 unq 4 iso 0 dist 5.15923 6.25845 4.00861 11.7624 9.30394 12.5897 numMergedOcc 0
50 mol 289 unq 5 iso 0 dist 5.15923 6.25845 4.00861 5.58788 5.84467 8.7503 numMergedOcc 0
51 mol 289 unq 6 iso 0 dist 6.96774 9.31611 5.03775 7.43524 9.84741 11.7353 numMergedOcc 0
52 mol 289 unq 7 iso 0 dist 7.14859 9.31611 8.95194 14.0575 8.5458 12.5897 numMergedOcc 0
53 mol 289 unq 8 iso 0 dist 7.14859 9.31611 8.95194 10.6005 8.56533 8.7503 numMergedOcc 0
54 mol 294 unq 0 iso 0 dist 6.37998 7.94656 3.33848 9.503 8.46311 10.0032 numMergedOcc 0
