0 mol 38 unq 0 iso 0 dist 7.96306 12.6215 7.55357 16.9937 9.83024 5.86243 16.8008 9.37501 8.62204 5.45205 numMergedOcc 0
1 mol 54 unq 0 iso 0 dist 9.04543 9.59233 6.79881 15.0279 6.01538 9.89535 9.94523 5.29182 8.80745 8.16424 numMergedOcc 0
2 mol 54 unq 1 iso 0 dist 7.62107 5.24333 6.79881 12.0849 6.01538 9.89535 11.3367 5.29182 8.80745 8.16424 numMergedOcc 0
3 mol 130 unq 0 iso 0 dist 9.92685 6.40926 7.9663 11.6055 5.84182 6.54338 12.6953 7.12852 7.06547 3.79867 numMergedOcc 0
4 mol 130 unq 1 iso 0 dist 9.92685 6.40926 7.9663 12.898 13.2888 7.47653 12.6953 7.12852 7.06547 9.23498 numMergedOcc 0
5 mol 219 unq 0 iso 0 dist 7.26376 6.90398 4.67452 15.7462 8.93116 9.86916 6.52136 4.74338 8.38773 13.1198 numMergedOcc 0
6 mol 223 unq 0 iso 0 dist 7.29418 5.59816 6.03408 12.511 7.75335 7.80764 14.1948 11.7563 8.85178 8.1388 numMergedOcc 0
7 mol 223 unq 1 iso 0 dist 7.29418 5.59816 6.03408 12.511 7.75335 7.80764 9.6936 8.87398 9.73123 14.288 numMergedOcc 0
8 mol 223 unq 2 iso 0 dist 8.63099 4.04961 6.03408 11.8532 7.75335 7.80764 11.4037 11.7563 8.85178 8.1388 numMergedOcc 0
9 mol 223 unq 3 iso 0 dist 8.63099 4.04961 6.03408 11.8532 7.75335 7.80764 9.36733 8.87398 9.73123 14.288 numMergedOcc 0
10 mol 266 unq 0 iso 0 dist 9.33791 11.5981 8.42706 10.8595 6.70676 6.58277 21.0321 16.8963 9.97206 12.6355 numMergedOcc 0
11 mol 266 unq 1 iso 0 dist 9.33791 11.5981 8.42706 18.5627 16.4476 8.12204 21.0321 16.8963 9.97206 5.85295 numMergedOcc 0
12 mol 266 unq 2 iso 0 dist 9.36806 7.43132 8.12204 10.3592 13.1611 6.58277 13.0277 5.85295 9.97206 12.6355 numMergedOcc 0
13 mol 266 unq 3 iso 0 dist 9.36806 7.43132 8.12204 13.6023 16.4476 8.42706 13.0277 5.85295 9.97206 16.8963 numMergedOcc 0
14 mol 266 unq 4 iso 0 dist 7.51446 8.18304 8.12204 14.0391 13.1611 6.58277 12.9819 5.85295 9.97206 12.6355 numMergedOcc 0
15 mol 266 unq 5 iso 0 dist 7.51446 8.18304 8.12204 15.3833 16.4476 8.42706 12.9819 5.85295 9.97206 16.8963 numMergedOcc 0
16 mol 279 unq 0 iso 0 dist 9.56601 6.17316 5.78017 6.70261 6.22487 6.12742 10.632 4.91802 8.9352 9.35656 numMergedOcc 0
17 mol 279 unq 1 iso 0 dist 6.70261 6.17316 6.12742 9.56601 6.22487 5.78017 10.632 9.35656 8.9352 4.91802 numMergedOcc 0
18 mol 287 unq 0 iso 0 dist 8.58119 5.26936 4.49185 11.4381 4.88833 7.22938 14.0803 10.6613 9.94851 12.7859 numMergedOcc 0
19 mol 287 unq 1 iso 0 dist 8.58119 5.26936 4.49185 13.5136 9.86126 9.94176 14.0803 10.6613 9.94851 15.0697 numMergedOcc 0
20 mol 288 unq 0 iso 0 dist 8.58119 5.26936 4.49185 11.4381 4.88833 7.22938 14.0803 10.6613 9.94851 12.7859 numMergedOcc 0
21 mol 288 unq 1 iso 0 dist 8.58119 5.26936 4.49185 13.5136 9.86126 9.94176 14.0803 10.6613 9.94851 15.0697 numMergedOcc 0
22 mol 289 unq 0 iso 0 dist 8.58119 5.26936 4.49185 11.4381 4.88833 7.22938 14.0803 10.6613 9.94851 12.7859 numMergedOcc 0
23 mol 289 unq 1 iso 0 dist 8.58119 5.26936 4.49185 13.5136 9.86126 9.94176 14.0803 10.6613 9.94851 15.0697 numMergedOcc 0
