0 mol 41 unq 0 iso 0 dist 9.95913 5.2891 6.75602 11.3609 5.42185 6.35506 numMergedOcc 0
1 mol 48 unq 0 iso 0 dist 7.49678 5.37112 5.06188 12.4893 5.75684 8.3491 numMergedOcc 0
2 mol 91 unq 0 iso 0 dist 5.22576 6.39764 8.91354 9.27894 5.09341 9.84288 numMergedOcc 0
3 mol 91 unq 1 iso 0 dist 8.65409 13.7719 8.91354 13.7163 5.09341 9.84288 numMergedOcc 0
4 mol 96 unq 0 iso 0 dist 8.92981 8.82781 8.9056 12.3972 6.29583 9.90938 numMergedOcc 0
5 mol 114 unq 0 iso 0 dist 8.80616 5.64342 8.57909 12.5083 10.2125 8.40389 numMergedOcc 0
6 mol 132 unq 0 iso 0 dist 8.97036 12.389 6.94745 9.40899 7.05332 8.40461 numMergedOcc 0
7 mol 183 unq 0 iso 0 dist 7.23572 12.7308 8.84987 11.9447 5.62792 7.50455 numMergedOcc 0
8 mol 198 unq 0 iso 0 dist 8.35833 11.9993 9.87574 15.5614 8.69902 9.40433 numMergedOcc 0
9 mol 205 unq 0 iso 0 dist 6.73513 11.9426 6.43519 6.3407 6.31671 7.53734 numMergedOcc 0
10 mol 224 unq 0 iso 0 dist 9.02319 7.49843 8.8113 12.5102 6.97024 7.71863 numMergedOcc 0
11 mol 266 unq 0 iso 0 dist 9.51286 8.13583 9.0836 6.61768 7.90149 8.9221 numMergedOcc 0
12 mol 266 unq 1 iso 0 dist 9.51286 4.80695 9.62494 6.61768 7.90149 9.51145 numMergedOcc 0
13 mol 271 unq 0 iso 0 dist 7.90629 6.04262 9.50884 14.2232 15.1078 9.86908 numMergedOcc 0
14 mol 271 unq 1 iso 0 dist 9.01599 10.8455 9.50884 20.1075 15.1078 9.86908 numMergedOcc 0
15 mol 277 unq 0 iso 0 dist 9.60879 4.00063 6.66936 8.20902 5.38166 6.42951 numMergedOcc 0
16 mol 277 unq 1 iso 0 dist 6.92271 4.00063 8.15119 8.20902 6.65084 6.42951 numMergedOcc 0
17 mol 277 unq 2 iso 0 dist 8.62666 9.31316 8.15119 9.55813 6.65084 6.42951 numMergedOcc 0
18 mol 292 unq 0 iso 0 dist 9.38624 6.92318 5.83342 12.361 7.60595 9.63325 numMergedOcc 0
19 mol 292 unq 1 iso 0 dist 9.38624 6.92318 5.83342 8.71745 6.03488 8.67283 numMergedOcc 0
