0 mol 17 unq 0 iso 0 dist 5.41678 7.79465 6.76604 9.13617 8.58468 8.23357 9.31896 7.18716 4.0384 11.7258 numMergedOcc 0
1 mol 17 unq 1 iso 0 dist 5.41678 7.79465 6.76604 5.02127 9.83791 11.5852 9.31896 7.18716 4.0384 12.3727 numMergedOcc 0
2 mol 17 unq 2 iso 0 dist 5.41678 7.79465 6.76604 4.88828 7.95007 12.3685 9.31896 7.18716 4.0384 13.7445 numMergedOcc 0
3 mol 48 unq 0 iso 0 dist 8.9175 12.4087 8.38139 15.0045 7.99735 5.0573 8.42234 6.77802 5.7037 9.165 numMergedOcc 0
4 mol 62 unq 0 iso 0 dist 6.75432 6.37499 8.19721 4.29159 6.30202 9.59858 3.89181 7.49792 4.29679 7.90686 numMergedOcc 0
5 mol 85 unq 0 iso 0 dist 6.24764 5.40682 7.52742 9.04544 9.37034 4.77114 10.8634 8.15861 7.14242 4.8069 numMergedOcc 0
6 mol 85 unq 1 iso 0 dist 6.24764 5.40682 7.52742 9.04544 9.37034 4.77114 11.7351 9.27814 15.6495 17.0484 numMergedOcc 0
7 mol 85 unq 2 iso 0 dist 6.24764 5.40682 7.52742 4.11312 6.60091 4.4924 10.8634 8.15861 7.14242 10.0178 numMergedOcc 0
8 mol 85 unq 3 iso 0 dist 6.24764 5.40682 7.52742 4.11312 6.60091 4.4924 11.7351 9.27814 15.6495 14.189 numMergedOcc 0
9 mol 95 unq 0 iso 0 dist 8.98691 8.21983 6.4081 6.17996 9.11115 4.79997 13.5194 9.98215 5.47525 8.58501 numMergedOcc 0
10 mol 239 unq 0 iso 0 dist 5.00508 8.24241 9.64578 7.26324 9.19442 15.2068 5.9338 7.45508 9.1722 11.6389 numMergedOcc 0
11 mol 239 unq 1 iso 0 dist 5.00508 8.24241 9.64578 7.26324 9.19442 15.2068 8.28284 5.79883 11.457 10.1445 numMergedOcc 0
12 mol 239 unq 2 iso 0 dist 5.00508 5.3748 7.02833 7.26324 9.19442 5.22517 5.9338 7.45508 11.2097 11.6389 numMergedOcc 0
13 mol 239 unq 3 iso 0 dist 5.00508 5.3748 7.02833 7.26324 9.19442 5.22517 8.28284 5.79883 6.10489 10.1445 numMergedOcc 0
14 mol 281 unq 0 iso 0 dist 9.79394 4.88562 9.18565 13.3861 7.90993 9.69803 16.2332 7.43535 16.2801 12.4082 numMergedOcc 0
15 mol 281 unq 1 iso 0 dist 6.52115 5.91239 9.18565 3.90611 7.90993 9.69803 12.9503 7.43535 16.2801 12.4082 numMergedOcc 0
16 mol 287 unq 0 iso 0 dist 8.62338 5.22713 5.06731 9.62966 4.75392 6.45653 7.52677 8.15636 6.00938 5.15725 numMergedOcc 0
17 mol 287 unq 1 iso 0 dist 8.62338 5.22713 5.06731 9.62966 4.75392 6.45653 9.46641 7.86292 4.88961 7.67235 numMergedOcc 0
18 mol 287 unq 2 iso 0 dist 8.62338 5.22713 5.06731 13.7068 8.61667 9.67944 7.52677 8.15636 6.00938 7.46917 numMergedOcc 0
19 mol 287 unq 3 iso 0 dist 8.62338 5.22713 5.06731 13.7068 8.61667 9.67944 9.46641 7.86292 4.88961 7.99757 numMergedOcc 0
20 mol 288 unq 0 iso 0 dist 8.62338 5.22713 5.06731 9.62966 4.75392 6.45653 7.52677 8.15636 6.00938 5.15725 numMergedOcc 0
21 mol 288 unq 1 iso 0 dist 8.62338 5.22713 5.06731 9.62966 4.75392 6.45653 9.46641 7.86292 4.88961 7.67235 numMergedOcc 0
22 mol 288 unq 2 iso 0 dist 8.62338 5.22713 5.06731 13.7068 8.61667 9.67944 7.52677 8.15636 6.00938 7.46917 numMergedOcc 0
23 mol 288 unq 3 iso 0 dist 8.62338 5.22713 5.06731 13.7068 8.61667 9.67944 9.46641 7.86292 4.88961 7.99757 numMergedOcc 0
24 mol 289 unq 0 iso 0 dist 8.62338 5.22713 5.06731 9.62966 4.75392 6.45653 7.52677 8.15636 6.00938 5.15725 numMergedOcc 0
25 mol 289 unq 1 iso 0 dist 8.62338 5.22713 5.06731 9.62966 4.75392 6.45653 9.46641 7.86292 4.88961 7.67235 numMergedOcc 0
26 mol 289 unq 2 iso 0 dist 8.62338 5.22713 5.06731 13.7068 8.61667 9.67944 7.52677 8.15636 6.00938 7.46917 numMergedOcc 0
27 mol 289 unq 3 iso 0 dist 8.62338 5.22713 5.06731 13.7068 8.61667 9.67944 9.46641 7.86292 4.88961 7.99757 numMergedOcc 0
