0 mol 13 unq 0 iso 0 dist 7.71544 4.43066 6.54276 4.14738 9.18487 7.98465 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 8.6112 9.63803 5.23054 6.66387 8.62693 5.84066 numMergedOcc 0
2 mol 41 unq 0 iso 0 dist 9.59131 8.0072 9.00425 5.14132 8.91418 7.29079 numMergedOcc 0
3 mol 78 unq 0 iso 0 dist 9.53794 7.32064 16.4946 10.1263 18.8672 5.47706 numMergedOcc 0
4 mol 78 unq 1 iso 0 dist 9.53794 5.85007 13.583 10.1263 18.8672 8.07568 numMergedOcc 0
5 mol 78 unq 2 iso 0 dist 9.84346 7.32064 13.8703 10.1263 13.8574 5.47706 numMergedOcc 0
6 mol 78 unq 3 iso 0 dist 9.84346 5.85007 11.9719 10.1263 13.8574 8.07568 numMergedOcc 0
7 mol 78 unq 4 iso 0 dist 9.46472 4.62314 13.8703 6.88255 13.8574 5.47706 numMergedOcc 0
8 mol 78 unq 5 iso 0 dist 9.46472 6.35234 11.9719 6.88255 13.8574 8.07568 numMergedOcc 0
9 mol 112 unq 0 iso 0 dist 7.84249 4.77996 3.78964 6.40435 9.45003 6.12922 numMergedOcc 0
10 mol 119 unq 0 iso 0 dist 7.72434 5.90003 11.4056 6.02826 13.6274 6.55202 numMergedOcc 0
11 mol 133 unq 0 iso 0 dist 8.64946 9.76097 3.75291 6.11049 6.73897 8.50705 numMergedOcc 0
12 mol 155 unq 0 iso 0 dist 6.91762 7.25009 5.05961 8.63858 9.75385 7.29911 numMergedOcc 0
13 mol 155 unq 1 iso 0 dist 6.91762 7.25009 5.05961 4.40049 8.02593 5.36254 numMergedOcc 0
14 mol 168 unq 0 iso 0 dist 9.76722 7.30338 8.01699 6.39941 12.2539 7.06851 numMergedOcc 0
15 mol 195 unq 0 iso 0 dist 8.97651 9.48766 8.34322 4.04021 11.8788 9.32333 numMergedOcc 0
16 mol 233 unq 0 iso 0 dist 7.74693 8.7831 4.98419 5.3674 7.83363 8.24424 numMergedOcc 0
17 mol 233 unq 1 iso 0 dist 7.74693 9.61071 7.08719 5.3674 7.83363 7.0942 numMergedOcc 0
18 mol 233 unq 2 iso 0 dist 7.74693 7.1229 10.7478 5.3674 7.83363 6.01775 numMergedOcc 0
19 mol 238 unq 0 iso 0 dist 7.82564 7.13727 3.68226 13.0115 13.4351 9.84652 numMergedOcc 0
20 mol 238 unq 1 iso 0 dist 7.82564 6.96382 3.72761 13.1765 10.4661 7.39547 numMergedOcc 0
21 mol 238 unq 2 iso 0 dist 7.82564 6.96382 3.72761 8.92175 9.57914 7.24334 numMergedOcc 0
22 mol 238 unq 3 iso 0 dist 9.51177 8.56975 3.68226 14.0686 13.4351 9.84652 numMergedOcc 0
23 mol 238 unq 4 iso 0 dist 9.51177 6.96382 5.17342 13.1765 9.46582 7.39547 numMergedOcc 0
24 mol 238 unq 5 iso 0 dist 9.51177 6.96382 5.17342 8.92175 12.4083 7.24334 numMergedOcc 0
25 mol 238 unq 6 iso 0 dist 9.91136 7.13727 5.17124 13.0115 11.5848 9.84652 numMergedOcc 0
26 mol 247 unq 0 iso 0 dist 8.67304 9.01651 7.1875 14.1218 14.3035 8.53041 numMergedOcc 0
27 mol 259 unq 0 iso 0 dist 5.30455 4.95855 6.09466 4.09442 8.65525 6.23661 numMergedOcc 0
28 mol 259 unq 1 iso 0 dist 7.34794 4.95855 5.49348 4.09442 10.5864 6.23661 numMergedOcc 0
29 mol 283 unq 0 iso 0 dist 8.36393 8.4275 3.77125 6.40657 11.5064 9.60574 numMergedOcc 0
