0 mol 0 unq 0 iso 0 dist 5.79741 8.74302 5.91458 6.2737 9.95014 13.7735 numMergedOcc 0
1 mol 7 unq 0 iso 0 dist 8.41173 6.22892 6.3027 12.9957 9.58865 10.1204 numMergedOcc 0
2 mol 7 unq 1 iso 0 dist 8.14952 5.83658 4.92824 15.4291 8.77648 10.1987 numMergedOcc 0
3 mol 7 unq 2 iso 0 dist 8.0166 6.22805 5.70161 5.85668 6.0323 7.15434 numMergedOcc 0
4 mol 7 unq 3 iso 0 dist 9.32945 6.22805 4.57188 15.279 8.85869 12.3221 numMergedOcc 0
5 mol 7 unq 4 iso 0 dist 9.90117 6.22805 6.09254 15.279 7.5298 12.3221 numMergedOcc 0
6 mol 7 unq 5 iso 0 dist 9.90117 6.22805 6.09254 11.7275 8.94874 11.9671 numMergedOcc 0
7 mol 12 unq 0 iso 0 dist 8.98466 8.17618 6.89226 8.5421 7.96154 12.8973 numMergedOcc 0
8 mol 19 unq 0 iso 0 dist 9.79426 7.78708 9.55318 9.27965 9.55978 15.0086 numMergedOcc 0
9 mol 19 unq 1 iso 0 dist 9.79426 7.84393 9.84922 9.27965 9.55978 13.7212 numMergedOcc 0
10 mol 30 unq 0 iso 0 dist 7.83595 8.37503 6.40527 6.78528 9.72314 6.83481 numMergedOcc 0
11 mol 66 unq 0 iso 0 dist 6.85819 8.31793 5.57361 7.41815 9.31938 13.8193 numMergedOcc 0
12 mol 73 unq 0 iso 0 dist 5.39171 4.24428 8.04817 6.13631 7.84699 6.10011 numMergedOcc 0
13 mol 73 unq 1 iso 0 dist 5.39171 4.24428 8.04817 12.6081 7.53504 15.5212 numMergedOcc 0
14 mol 73 unq 2 iso 0 dist 5.39171 6.30194 5.2774 6.13631 7.84699 8.124 numMergedOcc 0
15 mol 73 unq 3 iso 0 dist 5.39171 6.30194 5.2774 12.6081 7.53504 11.801 numMergedOcc 0
16 mol 73 unq 4 iso 0 dist 9.27355 4.24428 9.76331 6.13631 8.40844 6.10011 numMergedOcc 0
17 mol 73 unq 5 iso 0 dist 9.27355 4.24428 9.76331 16.1129 7.02351 15.7658 numMergedOcc 0
18 mol 73 unq 6 iso 0 dist 9.27355 4.24428 9.76331 12.6081 8.66342 15.5212 numMergedOcc 0
19 mol 73 unq 7 iso 0 dist 9.27355 6.30194 5.44275 6.13631 8.40844 8.124 numMergedOcc 0
20 mol 73 unq 8 iso 0 dist 9.27355 6.30194 5.44275 16.1129 7.02351 10.9082 numMergedOcc 0
21 mol 73 unq 9 iso 0 dist 9.27355 6.30194 5.44275 12.6081 8.66342 11.801 numMergedOcc 0
22 mol 73 unq 10 iso 0 dist 8.60363 4.24428 10.4402 6.13631 6.99156 6.10011 numMergedOcc 0
23 mol 73 unq 11 iso 0 dist 8.60363 4.24428 10.4402 12.6081 7.21285 15.5212 numMergedOcc 0
24 mol 73 unq 12 iso 0 dist 8.60363 6.30194 8.0624 6.13631 6.99156 8.124 numMergedOcc 0
25 mol 73 unq 13 iso 0 dist 8.60363 6.30194 8.0624 12.6081 7.21285 11.801 numMergedOcc 0
26 mol 114 unq 0 iso 0 dist 5.31281 9.24515 7.18757 7.22809 8.592 11.8382 numMergedOcc 0
27 mol 152 unq 0 iso 0 dist 7.53834 6.98781 7.24951 10.7416 7.21636 11.6015 numMergedOcc 0
28 mol 159 unq 0 iso 0 dist 7.60912 8.55431 8.50143 7.03515 9.37342 14.5723 numMergedOcc 0
29 mol 173 unq 0 iso 0 dist 5.97008 8.84671 8.75092 8.90271 7.13369 14.9854 numMergedOcc 0
30 mol 206 unq 0 iso 0 dist 8.93927 5.79186 11.2111 15.2726 7.4732 15.2064 numMergedOcc 0
31 mol 212 unq 0 iso 0 dist 9.26387 9.1384 8.61765 4.78007 6.41916 10.4861 numMergedOcc 0
32 mol 212 unq 1 iso 0 dist 9.26387 7.87125 9.7586 4.78007 6.41916 9.47932 numMergedOcc 0
33 mol 214 unq 0 iso 0 dist 9.81136 8.47248 4.82712 14.9808 5.69733 10.1886 numMergedOcc 0
34 mol 219 unq 0 iso 0 dist 4.67452 8.09769 10.0509 7.61939 7.98941 14.4403 numMergedOcc 0
35 mol 219 unq 1 iso 0 dist 4.67452 7.24832 5.48556 7.61939 7.98941 11.254 numMergedOcc 0
36 mol 220 unq 0 iso 0 dist 7.86207 8.9077 4.90657 11.9931 8.58709 6.21273 numMergedOcc 0
37 mol 220 unq 1 iso 0 dist 7.57716 9.85951 9.86723 7.52634 9.41713 16.3217 numMergedOcc 0
38 mol 223 unq 0 iso 0 dist 9.29204 9.94212 18.385 4.68566 9.86372 13.4805 numMergedOcc 0
39 mol 223 unq 1 iso 0 dist 9.29204 7.34316 8.16187 4.68566 9.86372 11.0403 numMergedOcc 0
40 mol 223 unq 2 iso 0 dist 9.14789 9.94212 19.0281 4.68566 7.70946 13.4805 numMergedOcc 0
41 mol 223 unq 3 iso 0 dist 9.14789 7.34316 11.2364 4.68566 7.70946 11.0403 numMergedOcc 0
42 mol 224 unq 0 iso 0 dist 6.6537 7.04127 6.46679 9.80029 7.46044 10.6043 numMergedOcc 0
43 mol 258 unq 0 iso 0 dist 6.08181 9.67877 5.09738 11.1086 9.26487 11.1385 numMergedOcc 0
44 mol 258 unq 1 iso 0 dist 6.08181 8.81059 13.8694 11.1086 9.26487 19.5306 numMergedOcc 0
45 mol 258 unq 2 iso 0 dist 6.08181 9.12006 14.0402 11.1086 9.26487 17.8125 numMergedOcc 0
46 mol 258 unq 3 iso 0 dist 7.70189 9.67877 10.4667 5.79358 6.59521 12.6095 numMergedOcc 0
47 mol 258 unq 4 iso 0 dist 7.70189 8.81059 9.22664 5.79358 6.59521 8.21585 numMergedOcc 0
48 mol 258 unq 5 iso 0 dist 7.70189 9.12006 13.0489 5.79358 6.59521 10.6274 numMergedOcc 0
49 mol 259 unq 0 iso 0 dist 6.76656 6.96379 5.71237 9.43627 9.16791 13.8844 numMergedOcc 0
50 mol 261 unq 0 iso 0 dist 6.41477 7.15785 4.50761 5.72823 9.56414 9.95681 numMergedOcc 0
51 mol 261 unq 1 iso 0 dist 6.41477 7.15785 4.50761 9.836 9.64886 13.5404 numMergedOcc 0
52 mol 261 unq 2 iso 0 dist 6.41477 9.43169 8.80293 5.72823 9.56414 9.05762 numMergedOcc 0
53 mol 261 unq 3 iso 0 dist 6.41477 9.43169 8.80293 9.836 9.64886 15.6165 numMergedOcc 0
54 mol 265 unq 0 iso 0 dist 4.03921 7.54805 5.11366 5.46523 5.10595 5.3051 numMergedOcc 0
55 mol 274 unq 0 iso 0 dist 9.07452 6.21831 6.57235 14.9337 8.17922 13.261 numMergedOcc 0
56 mol 274 unq 1 iso 0 dist 7.21004 6.21831 4.97216 6.33183 5.68643 8.78883 numMergedOcc 0
57 mol 274 unq 2 iso 0 dist 6.12202 9.81087 7.96313 5.64335 7.59956 13.3533 numMergedOcc 0
58 mol 274 unq 3 iso 0 dist 6.12202 9.81087 7.96313 13.0534 8.05503 12.0756 numMergedOcc 0
59 mol 274 unq 4 iso 0 dist 6.12202 9.81087 7.96313 9.24343 5.59151 5.82876 numMergedOcc 0
60 mol 274 unq 5 iso 0 dist 6.44266 9.79674 9.61244 6.26074 8.17922 12.336 numMergedOcc 0
61 mol 274 unq 6 iso 0 dist 6.44266 8.3291 6.57235 6.26074 8.17922 13.261 numMergedOcc 0
62 mol 274 unq 7 iso 0 dist 8.75703 9.79674 10.7877 9.34663 5.68643 15.4145 numMergedOcc 0
63 mol 274 unq 8 iso 0 dist 8.75703 8.3291 4.97216 9.34663 5.68643 8.78883 numMergedOcc 0
64 mol 279 unq 0 iso 0 dist 8.57035 5.17586 6.03718 13.2374 8.15805 12.5257 numMergedOcc 0
65 mol 279 unq 1 iso 0 dist 5.78017 6.47376 5.34376 4.77763 8.36655 8.68797 numMergedOcc 0
66 mol 279 unq 2 iso 0 dist 6.12742 9.6147 5.34376 5.44699 8.36655 8.68797 numMergedOcc 0
67 mol 279 unq 3 iso 0 dist 8.78203 6.47376 5.86731 12.3869 8.76889 12.0882 numMergedOcc 0
68 mol 279 unq 4 iso 0 dist 8.78203 6.47376 5.86731 7.27825 7.04397 9.65846 numMergedOcc 0
69 mol 280 unq 0 iso 0 dist 7.3304 8.27417 4.95798 10.5216 9.9227 8.80588 numMergedOcc 0
70 mol 282 unq 0 iso 0 dist 7.93511 6.84554 4.58403 8.96033 6.40686 10.161 numMergedOcc 0
71 mol 282 unq 1 iso 0 dist 7.93511 9.51581 5.04235 8.96033 6.40686 9.83042 numMergedOcc 0
72 mol 285 unq 0 iso 0 dist 8.08495 7.66291 8.39941 5.8542 8.33415 11.8098 numMergedOcc 0
