0 mol 9 unq 0 iso 0 dist 8.01055 11.69 6.8848 4.75533 7.48843 8.59513 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 8.01055 11.69 6.8848 5.85081 4.07023 6.59312 numMergedOcc 0
2 mol 10 unq 0 iso 0 dist 8.03458 6.61479 9.88507 12.037 9.00506 7.8329 numMergedOcc 0
3 mol 15 unq 0 iso 0 dist 9.05123 11.9755 8.3794 15.0497 10.0572 6.31608 numMergedOcc 0
4 mol 48 unq 0 iso 0 dist 9.40644 11.0398 7.66163 14.5028 6.64874 6.28603 numMergedOcc 0
5 mol 48 unq 1 iso 0 dist 9.40644 11.0398 7.66163 14.0354 5.68077 8.80303 numMergedOcc 0
6 mol 48 unq 2 iso 0 dist 9.40644 11.0398 7.66163 7.99434 3.85292 7.11491 numMergedOcc 0
7 mol 48 unq 3 iso 0 dist 5.35252 11.0398 9.48288 14.5028 10.6872 6.28603 numMergedOcc 0
8 mol 48 unq 4 iso 0 dist 5.35252 11.0398 9.48288 14.0354 9.24728 8.80303 numMergedOcc 0
9 mol 48 unq 5 iso 0 dist 5.35252 11.0398 9.48288 7.99434 6.44604 7.11491 numMergedOcc 0
10 mol 48 unq 6 iso 0 dist 9.53081 10.7098 8.82709 11.8063 9.165 8.40186 numMergedOcc 0
11 mol 48 unq 7 iso 0 dist 5.06188 11.0408 9.16212 14.2863 10.5404 5.73454 numMergedOcc 0
12 mol 48 unq 8 iso 0 dist 5.06188 11.0408 9.16212 13.9526 9.35478 8.2012 numMergedOcc 0
13 mol 48 unq 9 iso 0 dist 5.06188 11.0408 9.16212 8.10222 6.4561 7.1829 numMergedOcc 0
14 mol 79 unq 0 iso 0 dist 8.61089 5.37898 5.33546 11.6139 4.13187 6.86517 numMergedOcc 0
15 mol 79 unq 1 iso 0 dist 8.64686 8.69896 5.33546 6.65972 4.13187 6.86517 numMergedOcc 0
16 mol 83 unq 0 iso 0 dist 7.2118 10.4465 5.68212 7.69755 4.48523 8.99451 numMergedOcc 0
17 mol 116 unq 0 iso 0 dist 6.53824 10.4136 8.3971 11.3496 10.2914 8.58308 numMergedOcc 0
18 mol 116 unq 1 iso 0 dist 6.61973 10.4136 6.74026 11.3496 5.94177 8.58308 numMergedOcc 0
19 mol 124 unq 0 iso 0 dist 7.18976 10.1583 9.5436 8.50362 5.3096 8.65859 numMergedOcc 0
20 mol 129 unq 0 iso 0 dist 9.52061 5.9261 6.52844 11.0632 4.39633 8.98175 numMergedOcc 0
21 mol 158 unq 0 iso 0 dist 9.38856 7.46548 6.69487 9.27714 3.91702 4.6512 numMergedOcc 0
22 mol 186 unq 0 iso 0 dist 7.91838 6.10456 4.65126 10.3004 3.87593 5.25762 numMergedOcc 0
23 mol 214 unq 0 iso 0 dist 7.82201 11.045 5.82124 12.6344 6.3474 5.05626 numMergedOcc 0
24 mol 214 unq 1 iso 0 dist 7.82201 11.045 5.82124 17.2739 10.6456 8.41013 numMergedOcc 0
25 mol 214 unq 2 iso 0 dist 5.86911 5.74127 5.82124 9.834 6.3474 5.05626 numMergedOcc 0
26 mol 214 unq 3 iso 0 dist 5.86911 5.74127 5.82124 9.01979 10.6456 8.41013 numMergedOcc 0
27 mol 214 unq 4 iso 0 dist 7.89258 5.74127 8.31236 9.834 8.44414 5.05626 numMergedOcc 0
28 mol 214 unq 5 iso 0 dist 7.89258 5.74127 8.31236 9.01979 7.47595 8.41013 numMergedOcc 0
29 mol 249 unq 0 iso 0 dist 8.00386 11.2425 9.58168 6.62413 5.33399 8.76518 numMergedOcc 0
30 mol 250 unq 0 iso 0 dist 7.89067 4.45246 5.92578 13.3025 7.35853 9.25035 numMergedOcc 0
31 mol 258 unq 0 iso 0 dist 8.57274 12.3617 7.87648 17.8662 11.8118 9.36974 numMergedOcc 0
32 mol 266 unq 0 iso 0 dist 9.0836 8.25534 9.34312 14.2079 16.7215 7.63543 numMergedOcc 0
33 mol 273 unq 0 iso 0 dist 5.78262 7.10817 9.16554 13.5584 12.6217 9.81919 numMergedOcc 0
