0 mol 9 unq 0 iso 0 dist 8.01055 5.85081 4.07023 11.8626 6.89519 6.11048 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 8.01055 5.85081 4.07023 13.1565 5.24341 8.14998 numMergedOcc 0
2 mol 9 unq 2 iso 0 dist 8.61976 5.85081 7.19188 11.8626 10.3066 6.11048 numMergedOcc 0
3 mol 9 unq 3 iso 0 dist 8.61976 5.85081 7.19188 13.1565 7.67661 8.14998 numMergedOcc 0
4 mol 10 unq 0 iso 0 dist 9.29504 7.83083 15.0188 5.4053 14.5213 8.3613 numMergedOcc 0
5 mol 10 unq 1 iso 0 dist 9.29504 6.90469 12.4341 5.4053 14.5213 9.33141 numMergedOcc 0
6 mol 24 unq 0 iso 0 dist 5.85737 8.11143 4.19221 6.88453 8.0319 7.49157 numMergedOcc 0
7 mol 32 unq 0 iso 0 dist 9.28158 8.70331 4.52962 14.036 11.4833 8.91596 numMergedOcc 0
8 mol 43 unq 0 iso 0 dist 7.21995 8.81562 3.83842 4.80528 8.03754 9.02471 numMergedOcc 0
9 mol 76 unq 0 iso 0 dist 7.48127 5.91098 8.58474 10.2219 14.6364 7.61521 numMergedOcc 0
10 mol 78 unq 0 iso 0 dist 6.54194 9.93747 6.87984 9.1771 10.9328 8.34957 numMergedOcc 0
11 mol 122 unq 0 iso 0 dist 8.9864 4.821 7.33765 6.28781 11.3383 4.42563 numMergedOcc 0
12 mol 124 unq 0 iso 0 dist 7.18976 8.50362 5.3096 10.3233 12.5031 8.57739 numMergedOcc 0
13 mol 129 unq 0 iso 0 dist 7.6453 4.4077 6.61102 4.80675 8.00624 7.97548 numMergedOcc 0
14 mol 129 unq 1 iso 0 dist 7.6453 4.4077 6.61102 5.57362 11.5175 9.9291 numMergedOcc 0
15 mol 129 unq 2 iso 0 dist 7.6453 4.4077 6.61102 7.01358 8.42289 7.32151 numMergedOcc 0
16 mol 129 unq 3 iso 0 dist 7.6453 8.4874 9.0678 4.80675 8.00624 9.64164 numMergedOcc 0
17 mol 133 unq 0 iso 0 dist 5.79195 9.35049 4.63862 13.1243 9.64659 5.78814 numMergedOcc 0
18 mol 143 unq 0 iso 0 dist 5.40826 5.33772 3.66518 5.11989 9.35213 8.64905 numMergedOcc 0
19 mol 198 unq 0 iso 0 dist 8.51153 7.94413 7.14873 4.81051 9.53527 6.77156 numMergedOcc 0
20 mol 205 unq 0 iso 0 dist 4.81837 8.83628 9.70513 14.3203 17.0191 9.31158 numMergedOcc 0
21 mol 205 unq 1 iso 0 dist 6.43519 8.83628 6.82382 14.3203 11.2748 9.31158 numMergedOcc 0
22 mol 214 unq 0 iso 0 dist 5.86911 9.46274 14.085 14.5108 19.5839 9.06459 numMergedOcc 0
23 mol 214 unq 1 iso 0 dist 7.89258 9.46274 12.4498 14.5108 17.6894 9.06459 numMergedOcc 0
24 mol 224 unq 0 iso 0 dist 7.11741 6.06793 3.40786 5.68772 11.9013 9.57465 numMergedOcc 0
25 mol 224 unq 1 iso 0 dist 8.8113 6.06793 5.77577 5.68772 12.1258 9.57465 numMergedOcc 0
26 mol 228 unq 0 iso 0 dist 9.9685 6.72203 10.7078 5.79543 15.686 9.01231 numMergedOcc 0
27 mol 252 unq 0 iso 0 dist 8.19645 9.09279 10.2121 5.96471 13.2165 8.55044 numMergedOcc 0
28 mol 258 unq 0 iso 0 dist 8.58092 5.94328 5.05766 4.6881 11.1621 8.03012 numMergedOcc 0
29 mol 258 unq 1 iso 0 dist 7.40014 7.91978 5.05766 6.80596 11.1621 8.03012 numMergedOcc 0
30 mol 274 unq 0 iso 0 dist 9.34051 8.67957 4.66969 7.23876 8.88221 8.12739 numMergedOcc 0
31 mol 277 unq 0 iso 0 dist 8.15119 4.1545 9.21484 10.4297 9.92831 7.42932 numMergedOcc 0
32 mol 277 unq 1 iso 0 dist 8.15119 4.1545 9.21484 5.77904 4.81916 4.9764 numMergedOcc 0
33 mol 277 unq 2 iso 0 dist 8.15119 4.25172 10.3506 5.77904 4.81916 6.36559 numMergedOcc 0
34 mol 283 unq 0 iso 0 dist 9.28067 5.38739 8.09099 6.41403 14.8501 9.07995 numMergedOcc 0
35 mol 285 unq 0 iso 0 dist 7.872 7.08681 11.2722 9.237 15.1926 5.03601 numMergedOcc 0
36 mol 285 unq 1 iso 0 dist 6.32984 7.08681 3.57803 9.237 8.46833 5.03601 numMergedOcc 0
37 mol 287 unq 0 iso 0 dist 6.45597 8.73403 3.65914 5.10722 9.32175 9.76232 numMergedOcc 0
38 mol 288 unq 0 iso 0 dist 6.45597 8.73403 3.65914 5.10722 9.32175 9.76232 numMergedOcc 0
39 mol 289 unq 0 iso 0 dist 6.45597 8.73403 3.65914 5.10722 9.32175 9.76232 numMergedOcc 0
40 mol 294 unq 0 iso 0 dist 6.37998 7.94656 3.33848 6.99988 9.97601 8.88595 numMergedOcc 0
