0 mol 43 unq 0 iso 0 dist 9.16827 5.19462 5.07458 6.11363 13.8936 9.50614 numMergedOcc 0
1 mol 43 unq 1 iso 0 dist 9.16827 5.19462 5.07458 10.4149 6.75943 8.34145 numMergedOcc 0
2 mol 59 unq 0 iso 0 dist 8.97292 5.73075 13.6023 11.7825 19.8935 8.66724 numMergedOcc 0
3 mol 59 unq 1 iso 0 dist 6.85083 5.73075 7.31539 11.7825 12.4823 8.66724 numMergedOcc 0
4 mol 89 unq 0 iso 0 dist 9.51842 6.00509 10.4274 5.87704 7.47974 8.05579 numMergedOcc 0
5 mol 89 unq 1 iso 0 dist 8.25651 6.00509 6.13636 5.87704 5.51831 8.05579 numMergedOcc 0
6 mol 95 unq 0 iso 0 dist 6.05043 9.05612 3.94537 10.6401 10.3995 8.75345 numMergedOcc 0
7 mol 122 unq 0 iso 0 dist 7.43775 5.42764 4.0204 5.69357 11.0694 9.47049 numMergedOcc 0
8 mol 122 unq 1 iso 0 dist 8.09594 5.42764 3.90443 5.69357 13.0148 9.47049 numMergedOcc 0
9 mol 122 unq 2 iso 0 dist 5.09114 7.34585 6.9791 10.8594 12.6348 9.47049 numMergedOcc 0
10 mol 129 unq 0 iso 0 dist 8.14071 7.11486 6.16616 5.22333 5.58833 8.25397 numMergedOcc 0
11 mol 158 unq 0 iso 0 dist 8.1504 6.22696 4.63654 5.65593 12.3989 9.10671 numMergedOcc 0
12 mol 178 unq 0 iso 0 dist 6.01118 8.74572 10.8974 5.23156 7.06025 7.86352 numMergedOcc 0
13 mol 213 unq 0 iso 0 dist 9.40939 7.31478 11.7829 4.44853 11.7255 7.90657 numMergedOcc 0
14 mol 213 unq 1 iso 0 dist 9.06306 7.31478 4.72944 4.44853 7.94911 7.90657 numMergedOcc 0
15 mol 214 unq 0 iso 0 dist 8.3035 8.9694 8.48942 15.6849 16.9119 9.43017 numMergedOcc 0
16 mol 214 unq 1 iso 0 dist 9.01896 8.70011 8.52282 6.3054 10.6947 4.85332 numMergedOcc 0
17 mol 217 unq 0 iso 0 dist 8.28941 5.01648 4.64118 10.7302 7.60269 9.37602 numMergedOcc 0
18 mol 217 unq 1 iso 0 dist 8.28941 5.01648 4.64118 5.75957 10.6124 8.26522 numMergedOcc 0
19 mol 238 unq 0 iso 0 dist 9.29203 9.97859 16.7443 6.10342 14.4013 4.66186 numMergedOcc 0
20 mol 238 unq 1 iso 0 dist 7.62771 9.97859 13.1408 6.10342 11.1002 4.66186 numMergedOcc 0
21 mol 238 unq 2 iso 0 dist 7.80166 9.97859 10.4706 6.10342 9.72188 4.66186 numMergedOcc 0
22 mol 284 unq 0 iso 0 dist 9.27402 7.21255 10.6409 11.6294 15.415 9.69019 numMergedOcc 0
23 mol 284 unq 1 iso 0 dist 9.26573 7.21255 6.25608 11.6294 12.5394 9.69019 numMergedOcc 0
