0 mol 7 unq 0 iso 0 dist 8.41173 6.22892 6.3027 12.9957 9.58865 10.1204 7.15287 13.8674 8.41585 15.8143 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.14952 5.83658 4.92824 15.4291 8.77648 10.1987 10.826 13.7022 9.60499 17.7656 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 8.0166 6.22805 5.70161 5.85668 6.0323 7.15434 6.96396 12.2471 7.10621 11.2706 numMergedOcc 0
3 mol 7 unq 3 iso 0 dist 9.32945 6.22805 4.57188 15.279 8.85869 12.3221 6.96396 10.2729 7.10621 14.06 numMergedOcc 0
4 mol 7 unq 4 iso 0 dist 9.90117 6.22805 6.09254 15.279 7.5298 12.3221 6.96396 7.21217 7.10621 14.06 numMergedOcc 0
5 mol 7 unq 5 iso 0 dist 9.90117 6.22805 6.09254 11.7275 8.94874 11.9671 6.96396 7.21217 7.10621 5.77391 numMergedOcc 0
6 mol 19 unq 0 iso 0 dist 9.79426 7.84393 9.84922 9.27965 9.55978 13.7212 9.01721 13.8602 7.82074 12.0578 numMergedOcc 0
7 mol 66 unq 0 iso 0 dist 6.85819 8.31793 5.57361 7.41815 9.31938 13.8193 5.95767 10.7538 8.96624 13.1023 numMergedOcc 0
8 mol 73 unq 0 iso 0 dist 5.39171 4.24428 8.04817 6.13631 7.84699 6.10011 6.58444 11.905 5.93252 8.3449 numMergedOcc 0
9 mol 73 unq 1 iso 0 dist 5.39171 4.24428 8.04817 12.6081 7.53504 15.5212 6.58444 11.905 5.93252 18.9667 numMergedOcc 0
10 mol 73 unq 2 iso 0 dist 5.39171 6.30194 5.2774 6.13631 7.84699 8.124 10.5627 6.89722 6.19304 13.4367 numMergedOcc 0
11 mol 73 unq 3 iso 0 dist 5.39171 6.30194 5.2774 12.6081 7.53504 11.801 10.5627 6.89722 6.19304 9.64124 numMergedOcc 0
12 mol 73 unq 4 iso 0 dist 9.27355 4.24428 9.76331 6.13631 8.40844 6.10011 6.58444 14.8258 5.93252 8.3449 numMergedOcc 0
13 mol 73 unq 5 iso 0 dist 9.27355 4.24428 9.76331 16.1129 7.02351 15.7658 6.58444 14.8258 5.93252 21.2837 numMergedOcc 0
14 mol 73 unq 6 iso 0 dist 9.27355 4.24428 9.76331 12.6081 8.66342 15.5212 6.58444 14.8258 5.93252 18.9667 numMergedOcc 0
15 mol 73 unq 7 iso 0 dist 9.27355 6.30194 5.44275 6.13631 8.40844 8.124 10.5627 7.26679 6.19304 13.4367 numMergedOcc 0
16 mol 73 unq 8 iso 0 dist 9.27355 6.30194 5.44275 16.1129 7.02351 10.9082 10.5627 7.26679 6.19304 10.3774 numMergedOcc 0
17 mol 73 unq 9 iso 0 dist 9.27355 6.30194 5.44275 12.6081 8.66342 11.801 10.5627 7.26679 6.19304 9.64124 numMergedOcc 0
18 mol 73 unq 10 iso 0 dist 8.60363 4.24428 10.4402 6.13631 6.99156 6.10011 6.58444 14.0323 5.93252 8.3449 numMergedOcc 0
19 mol 73 unq 11 iso 0 dist 8.60363 4.24428 10.4402 12.6081 7.21285 15.5212 6.58444 14.0323 5.93252 18.9667 numMergedOcc 0
20 mol 73 unq 12 iso 0 dist 8.60363 6.30194 8.0624 6.13631 6.99156 8.124 10.5627 10.1503 6.19304 13.4367 numMergedOcc 0
21 mol 73 unq 13 iso 0 dist 8.60363 6.30194 8.0624 12.6081 7.21285 11.801 10.5627 10.1503 6.19304 9.64124 numMergedOcc 0
22 mol 114 unq 0 iso 0 dist 5.31281 9.24515 7.18757 7.22809 8.592 11.8382 5.24877 8.42445 7.5732 9.52181 numMergedOcc 0
23 mol 220 unq 0 iso 0 dist 7.86207 8.9077 4.90657 11.9931 8.58709 6.21273 10.6943 9.8711 9.23153 5.1021 numMergedOcc 0
24 mol 220 unq 1 iso 0 dist 7.86207 8.9077 4.90657 11.9931 8.58709 6.21273 15.396 12.6756 8.24498 6.29601 numMergedOcc 0
25 mol 223 unq 0 iso 0 dist 9.29204 9.94212 18.385 4.68566 9.86372 13.4805 11.4946 18.8401 8.77153 13.2972 numMergedOcc 0
26 mol 223 unq 1 iso 0 dist 9.29204 9.94212 18.385 4.68566 9.86372 13.4805 13.1422 22.2602 8.6166 13.9648 numMergedOcc 0
27 mol 223 unq 2 iso 0 dist 9.14789 9.94212 19.0281 4.68566 7.70946 13.4805 11.4946 19.381 8.77153 13.2972 numMergedOcc 0
28 mol 223 unq 3 iso 0 dist 9.14789 9.94212 19.0281 4.68566 7.70946 13.4805 13.1422 21.4312 8.6166 13.9648 numMergedOcc 0
29 mol 224 unq 0 iso 0 dist 6.6537 7.04127 6.46679 9.80029 7.46044 10.6043 11.7724 14.4547 9.40098 14.0352 numMergedOcc 0
30 mol 224 unq 1 iso 0 dist 6.6537 7.04127 6.46679 9.80029 7.46044 10.6043 4.55824 9.75313 6.61986 13.1803 numMergedOcc 0
31 mol 258 unq 0 iso 0 dist 6.08181 8.81059 13.8694 11.1086 9.26487 19.5306 9.78068 15.2652 6.42289 19.8503 numMergedOcc 0
32 mol 258 unq 1 iso 0 dist 7.70189 8.81059 9.22664 5.79358 6.59521 8.21585 9.78068 8.58088 6.42289 5.13233 numMergedOcc 0
33 mol 259 unq 0 iso 0 dist 6.76656 6.96379 5.71237 9.43627 9.16791 13.8844 10.908 6.77279 8.13497 12.4673 numMergedOcc 0
34 mol 259 unq 1 iso 0 dist 6.76656 6.96379 5.71237 9.43627 9.16791 13.8844 12.7595 9.58006 7.88519 16.6792 numMergedOcc 0
35 mol 261 unq 0 iso 0 dist 6.41477 7.15785 4.50761 5.72823 9.56414 9.95681 6.5875 10.2386 8.02547 5.79827 numMergedOcc 0
36 mol 261 unq 1 iso 0 dist 6.41477 7.15785 4.50761 9.836 9.64886 13.5404 6.5875 10.2386 8.02547 14.7193 numMergedOcc 0
37 mol 261 unq 2 iso 0 dist 6.41477 9.43169 8.80293 5.72823 9.56414 9.05762 6.5875 10.2386 6.05727 5.79827 numMergedOcc 0
38 mol 261 unq 3 iso 0 dist 6.41477 9.43169 8.80293 9.836 9.64886 15.6165 6.5875 10.2386 6.05727 14.7193 numMergedOcc 0
39 mol 265 unq 0 iso 0 dist 4.03921 7.54805 5.11366 5.46523 5.10595 5.3051 12.5953 12.3211 8.4218 11.4819 numMergedOcc 0
40 mol 274 unq 0 iso 0 dist 9.07452 6.21831 6.57235 14.9337 8.17922 13.261 6.11218 7.80446 9.10818 10.374 numMergedOcc 0
41 mol 274 unq 1 iso 0 dist 7.21004 6.21831 4.97216 6.33183 5.68643 8.78883 6.11218 9.91395 9.10818 7.48637 numMergedOcc 0
42 mol 274 unq 2 iso 0 dist 6.44266 8.3291 6.57235 6.26074 8.17922 13.261 6.98398 7.80446 9.10818 10.374 numMergedOcc 0
43 mol 274 unq 3 iso 0 dist 8.75703 8.3291 4.97216 9.34663 5.68643 8.78883 6.98398 9.91395 9.10818 7.48637 numMergedOcc 0
44 mol 279 unq 0 iso 0 dist 8.57035 5.17586 6.03718 13.2374 8.15805 12.5257 5.9229 14.3672 9.70696 18.8077 numMergedOcc 0
45 mol 280 unq 0 iso 0 dist 7.3304 8.27417 4.95798 10.5216 9.9227 8.80588 12.0417 11.1402 6.53701 8.30978 numMergedOcc 0
46 mol 280 unq 1 iso 0 dist 7.3304 8.27417 4.95798 10.5216 9.9227 8.80588 7.26698 8.85762 6.0664 5.80223 numMergedOcc 0
47 mol 282 unq 0 iso 0 dist 7.93511 6.84554 4.58403 8.96033 6.40686 10.161 9.67023 5.67266 8.76532 4.89059 numMergedOcc 0
48 mol 282 unq 1 iso 0 dist 7.93511 9.51581 5.04235 8.96033 6.40686 9.83042 9.67023 5.67266 6.33524 4.89059 numMergedOcc 0
