0 mol 4 unq 0 iso 0 dist 8.23852 6.00772 9.88068 5.39008 4.46089 5.93454 numMergedOcc 0
1 mol 7 unq 0 iso 0 dist 8.85869 14.9956 8.94586 18.2611 9.68824 8.50044 numMergedOcc 0
2 mol 7 unq 1 iso 0 dist 6.0323 9.89662 5.27578 8.05125 5.96526 8.50044 numMergedOcc 0
3 mol 98 unq 0 iso 0 dist 8.87856 4.81103 4.94406 7.88143 6.62867 7.67564 numMergedOcc 0
4 mol 98 unq 1 iso 0 dist 8.87856 4.81103 4.94406 6.62952 11.2334 8.60103 numMergedOcc 0
5 mol 98 unq 2 iso 0 dist 6.2491 4.81103 7.2337 7.88143 12.7928 7.67564 numMergedOcc 0
6 mol 98 unq 3 iso 0 dist 6.2491 4.81103 7.2337 6.62952 7.89992 8.60103 numMergedOcc 0
7 mol 98 unq 4 iso 0 dist 3.59451 7.22196 7.2337 10.5625 12.7928 7.67564 numMergedOcc 0
8 mol 98 unq 5 iso 0 dist 3.59451 7.22196 7.2337 4.3521 7.89992 8.60103 numMergedOcc 0
9 mol 124 unq 0 iso 0 dist 5.61764 4.26006 8.18186 8.03603 5.26643 9.5436 numMergedOcc 0
10 mol 125 unq 0 iso 0 dist 6.6081 7.74181 9.2657 14.422 15.509 8.74577 numMergedOcc 0
11 mol 125 unq 1 iso 0 dist 6.6081 7.74181 9.2657 16.7991 18.0039 9.7728 numMergedOcc 0
12 mol 125 unq 2 iso 0 dist 6.6081 7.74181 9.2657 8.75402 4.77979 6.75122 numMergedOcc 0
13 mol 125 unq 3 iso 0 dist 9.64304 8.27647 9.2657 16.4433 15.509 8.74577 numMergedOcc 0
14 mol 125 unq 4 iso 0 dist 9.64304 8.27647 9.2657 16.3389 18.0039 9.7728 numMergedOcc 0
15 mol 125 unq 5 iso 0 dist 9.64304 8.27647 9.2657 8.48363 4.77979 6.75122 numMergedOcc 0
16 mol 141 unq 0 iso 0 dist 8.51265 13.1683 7.35385 14.305 13.3661 8.81111 numMergedOcc 0
17 mol 141 unq 1 iso 0 dist 8.51265 9.00056 8.35864 14.305 13.3661 5.66405 numMergedOcc 0
18 mol 156 unq 0 iso 0 dist 6.47989 6.07262 8.32227 5.50879 4.68339 5.13522 numMergedOcc 0
19 mol 192 unq 0 iso 0 dist 7.72242 4.71967 7.04366 5.83093 5.21255 8.29166 numMergedOcc 0
20 mol 192 unq 1 iso 0 dist 7.72242 6.75301 9.99783 5.83093 5.21255 5.62421 numMergedOcc 0
21 mol 193 unq 0 iso 0 dist 9.16852 5.35985 9.82224 7.71716 3.53549 9.16058 numMergedOcc 0
22 mol 193 unq 1 iso 0 dist 8.6538 9.89855 9.82224 10.3933 3.53549 9.16058 numMergedOcc 0
23 mol 193 unq 2 iso 0 dist 5.19654 12.9817 9.82224 8.71993 3.53549 9.16058 numMergedOcc 0
24 mol 205 unq 0 iso 0 dist 7.14871 9.24673 9.28689 16.9001 12.6987 9.37516 numMergedOcc 0
25 mol 220 unq 0 iso 0 dist 9.60247 12.831 8.8938 13.9443 4.95734 9.19001 numMergedOcc 0
26 mol 220 unq 1 iso 0 dist 8.57273 5.57992 8.8938 11.1625 4.95734 9.19001 numMergedOcc 0
27 mol 224 unq 0 iso 0 dist 7.46044 4.07416 6.48885 5.07376 4.49347 6.84722 numMergedOcc 0
28 mol 239 unq 0 iso 0 dist 8.78008 5.41296 5.4347 7.80073 8.20191 8.87182 numMergedOcc 0
29 mol 265 unq 0 iso 0 dist 8.19772 11.7401 7.49913 20.7845 14.4383 9.68583 numMergedOcc 0
30 mol 277 unq 0 iso 0 dist 9.42812 13.008 5.92532 13.9579 5.95045 9.35976 numMergedOcc 0
