0 mol 21 unq 0 iso 0 dist 8.38921 6.86154 6.08338 14.3503 10.7452 8.038 numMergedOcc 0
1 mol 73 unq 0 iso 0 dist 6.04163 11.4785 5.64598 11.3999 8.04817 6.4154 numMergedOcc 0
2 mol 73 unq 1 iso 0 dist 8.88953 12.0993 5.64598 12.6863 8.04817 6.4154 numMergedOcc 0
3 mol 88 unq 0 iso 0 dist 8.25679 7.09701 9.10189 11.5416 7.70573 7.19209 numMergedOcc 0
4 mol 127 unq 0 iso 0 dist 8.09965 9.46933 8.59981 16.6814 16.0489 8.20636 numMergedOcc 0
5 mol 127 unq 1 iso 0 dist 8.09965 9.46933 8.59981 9.78409 9.75166 8.03243 numMergedOcc 0
6 mol 133 unq 0 iso 0 dist 8.94909 11.1266 7.92688 13.844 14.4683 8.25207 numMergedOcc 0
7 mol 134 unq 0 iso 0 dist 8.75736 9.88404 8.94837 14.045 15.8885 8.33489 numMergedOcc 0
8 mol 134 unq 1 iso 0 dist 6.76166 6.15672 8.94837 12.8198 15.8885 8.33489 numMergedOcc 0
9 mol 134 unq 2 iso 0 dist 6.32178 9.88404 7.77454 14.045 10.3334 8.33489 numMergedOcc 0
10 mol 134 unq 3 iso 0 dist 7.2977 6.15672 7.77454 12.8198 10.3334 8.33489 numMergedOcc 0
11 mol 173 unq 0 iso 0 dist 9.09857 9.00192 8.31897 17.2344 14.7376 9.25763 numMergedOcc 0
12 mol 173 unq 1 iso 0 dist 9.09857 9.00192 8.31897 16.4579 12.3698 9.63102 numMergedOcc 0
13 mol 175 unq 0 iso 0 dist 7.94593 11.0605 9.31887 13.0267 12.1089 6.84347 numMergedOcc 0
14 mol 224 unq 0 iso 0 dist 9.61379 5.98813 6.67585 11.3088 5.41021 6.4508 numMergedOcc 0
15 mol 235 unq 0 iso 0 dist 8.84872 13.4086 9.58736 13.4409 5.47633 8.60471 numMergedOcc 0
16 mol 235 unq 1 iso 0 dist 8.79626 12.9417 7.32211 17.8987 11.9322 8.60471 numMergedOcc 0
17 mol 238 unq 0 iso 0 dist 6.51823 6.04481 7.2766 12.8762 13.1103 8.61709 numMergedOcc 0
18 mol 257 unq 0 iso 0 dist 8.95261 9.63067 7.14834 8.42116 5.86413 9.46934 numMergedOcc 0
19 mol 257 unq 1 iso 0 dist 7.80336 5.47761 7.14834 8.53984 5.86413 9.46934 numMergedOcc 0
20 mol 282 unq 0 iso 0 dist 7.12228 7.00729 7.32347 11.6773 8.85797 5.2527 numMergedOcc 0
