0 mol 17 unq 0 iso 0 dist 8.59045 6.25587 4.47542 10.1274 8.58312 9.78331 numMergedOcc 0
1 mol 32 unq 0 iso 0 dist 8.48238 7.98414 10.098 10.2135 11.4833 7.99969 numMergedOcc 0
2 mol 59 unq 0 iso 0 dist 9.77244 8.55279 3.85789 5.83686 9.83775 6.73347 numMergedOcc 0
3 mol 62 unq 0 iso 0 dist 4.93315 6.02731 8.90117 11.4221 13.6275 7.56205 numMergedOcc 0
4 mol 62 unq 1 iso 0 dist 4.93315 6.02731 8.90117 4.05764 8.54481 4.74544 numMergedOcc 0
5 mol 67 unq 0 iso 0 dist 7.72671 5.86118 4.53519 6.24947 12.3125 9.49144 numMergedOcc 0
6 mol 92 unq 0 iso 0 dist 9.9259 9.14582 4.92054 4.91291 7.11695 8.91313 numMergedOcc 0
7 mol 96 unq 0 iso 0 dist 9.48287 9.46918 8.0334 12.4028 13.9613 8.39111 numMergedOcc 0
8 mol 100 unq 0 iso 0 dist 9.82345 5.38064 5.02461 10.3471 10.9423 7.80975 numMergedOcc 0
9 mol 100 unq 1 iso 0 dist 9.82345 5.38064 5.02461 7.25847 10.3583 7.10378 numMergedOcc 0
10 mol 100 unq 2 iso 0 dist 9.25746 8.11279 9.64716 6.20162 9.22737 8.76378 numMergedOcc 0
11 mol 171 unq 0 iso 0 dist 7.38306 8.53734 14.1926 11.071 18.3361 9.61462 numMergedOcc 0
12 mol 238 unq 0 iso 0 dist 6.45589 6.38654 4.04422 6.89249 11.4073 8.94014 numMergedOcc 0
13 mol 238 unq 1 iso 0 dist 6.45589 6.38654 4.04422 9.42382 10.6583 7.02333 numMergedOcc 0
14 mol 238 unq 2 iso 0 dist 6.45589 6.38654 4.04422 11.5722 11.147 8.67864 numMergedOcc 0
15 mol 243 unq 0 iso 0 dist 6.77411 7.24253 13.3958 6.54531 12.1071 7.49645 numMergedOcc 0
16 mol 243 unq 1 iso 0 dist 6.77411 7.24253 13.3958 11.6229 16.8666 9.9222 numMergedOcc 0
17 mol 271 unq 0 iso 0 dist 8.56431 8.97962 4.17949 10.8708 11.2198 8.98576 numMergedOcc 0
18 mol 271 unq 1 iso 0 dist 8.56431 8.97962 4.17949 12.9071 12.8668 8.92636 numMergedOcc 0
