0 mol 4 unq 0 iso 0 dist 8.23852 5.39008 4.46089 6.00772 9.88068 5.93454 numMergedOcc 0
1 mol 7 unq 0 iso 0 dist 6.0323 8.05125 5.96526 9.89662 5.27578 8.50044 numMergedOcc 0
2 mol 54 unq 0 iso 0 dist 6.10175 6.29755 12.1689 5.01159 5.7405 10.1502 numMergedOcc 0
3 mol 54 unq 1 iso 0 dist 6.10175 7.4038 11.8364 5.01159 5.7405 12.3954 numMergedOcc 0
4 mol 56 unq 0 iso 0 dist 9.49909 8.0757 4.98324 6.93938 8.81003 10.4259 numMergedOcc 0
5 mol 56 unq 1 iso 0 dist 8.37022 9.8958 4.98324 3.71013 8.81003 10.4259 numMergedOcc 0
6 mol 71 unq 0 iso 0 dist 4.87423 7.12853 5.01302 5.86791 9.03987 12.4626 numMergedOcc 0
7 mol 71 unq 1 iso 0 dist 4.76283 6.14513 5.01302 9.2661 9.03987 12.4626 numMergedOcc 0
8 mol 71 unq 2 iso 0 dist 4.76283 7.4392 4.64256 9.2661 9.03987 13.6786 numMergedOcc 0
9 mol 71 unq 3 iso 0 dist 7.75237 7.12853 9.08204 5.86791 8.63476 12.4626 numMergedOcc 0
10 mol 73 unq 0 iso 0 dist 7.21285 5.68894 7.09483 14.9324 9.53327 14.9361 numMergedOcc 0
11 mol 73 unq 1 iso 0 dist 7.21285 7.32265 4.68175 14.9324 9.53327 10.5281 numMergedOcc 0
12 mol 98 unq 0 iso 0 dist 8.87856 7.88143 6.62867 4.81103 4.94406 7.67564 numMergedOcc 0
13 mol 98 unq 1 iso 0 dist 8.87856 6.62952 11.2334 4.81103 4.94406 8.60103 numMergedOcc 0
14 mol 98 unq 2 iso 0 dist 6.2491 7.88143 12.7928 4.81103 7.2337 7.67564 numMergedOcc 0
15 mol 98 unq 3 iso 0 dist 6.2491 6.62952 7.89992 4.81103 7.2337 8.60103 numMergedOcc 0
16 mol 98 unq 4 iso 0 dist 3.59451 4.3521 7.89992 7.22196 7.2337 8.60103 numMergedOcc 0
17 mol 124 unq 0 iso 0 dist 5.61764 8.03603 5.26643 4.26006 8.18186 9.5436 numMergedOcc 0
18 mol 125 unq 0 iso 0 dist 6.6081 8.75402 4.77979 7.74181 9.2657 6.75122 numMergedOcc 0
19 mol 125 unq 1 iso 0 dist 9.64304 8.48363 4.77979 8.27647 9.2657 6.75122 numMergedOcc 0
20 mol 131 unq 0 iso 0 dist 7.8034 9.14809 9.45822 11.5898 9.39811 17.3821 numMergedOcc 0
21 mol 131 unq 1 iso 0 dist 7.8034 6.45169 10.1774 11.5898 9.39811 15.8766 numMergedOcc 0
22 mol 152 unq 0 iso 0 dist 7.99446 9.54774 8.8525 5.8155 9.62138 14.4264 numMergedOcc 0
23 mol 152 unq 1 iso 0 dist 7.21636 9.54774 12.5216 5.8155 5.11444 14.4264 numMergedOcc 0
24 mol 156 unq 0 iso 0 dist 6.47989 5.50879 4.68339 6.07262 8.32227 5.13522 numMergedOcc 0
25 mol 184 unq 0 iso 0 dist 5.13722 8.49577 8.78766 4.84884 5.0207 12.0267 numMergedOcc 0
26 mol 192 unq 0 iso 0 dist 7.72242 5.83093 5.21255 10.6772 8.96522 12.827 numMergedOcc 0
27 mol 192 unq 1 iso 0 dist 7.72242 5.83093 5.21255 4.71967 7.04366 8.29166 numMergedOcc 0
28 mol 192 unq 2 iso 0 dist 7.72242 5.83093 5.21255 6.75301 9.99783 5.62421 numMergedOcc 0
29 mol 193 unq 0 iso 0 dist 9.16852 7.71716 3.53549 5.35985 9.82224 9.16058 numMergedOcc 0
30 mol 193 unq 1 iso 0 dist 9.16852 7.71716 3.53549 12.1335 8.95886 9.39453 numMergedOcc 0
31 mol 193 unq 2 iso 0 dist 5.19654 8.71993 3.53549 12.9817 9.82224 9.16058 numMergedOcc 0
32 mol 193 unq 3 iso 0 dist 5.19654 8.71993 3.53549 10.7013 8.95886 9.39453 numMergedOcc 0
33 mol 224 unq 0 iso 0 dist 9.92947 5.07376 12.9085 6.64902 9.42667 10.9219 numMergedOcc 0
34 mol 224 unq 1 iso 0 dist 7.46044 5.07376 4.49347 4.07416 6.48885 6.84722 numMergedOcc 0
35 mol 224 unq 2 iso 0 dist 8.68767 8.18749 4.42976 5.77278 9.42667 11.4169 numMergedOcc 0
36 mol 239 unq 0 iso 0 dist 8.78008 7.80073 8.20191 5.41296 5.4347 8.87182 numMergedOcc 0
37 mol 256 unq 0 iso 0 dist 8.11884 9.92947 10.2154 12.3321 7.40057 15.1085 numMergedOcc 0
38 mol 277 unq 0 iso 0 dist 9.42812 6.40125 10.3278 13.008 5.92532 14.3257 numMergedOcc 0
