0 mol 8 unq 0 iso 0 dist 9.95422 6.92865 12.3778 8.89145 12.7683 8.02605 6.88402 13.3838 8.99126 14.849 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 7.65219 6.92865 5.95251 8.89145 13.0138 8.02605 6.88402 5.46588 8.99126 14.849 numMergedOcc 0
2 mol 19 unq 0 iso 0 dist 6.8824 7.84393 10.38 7.78708 5.3957 8.01051 6.31174 13.0619 8.73972 12.3782 numMergedOcc 0
3 mol 19 unq 1 iso 0 dist 8.33492 7.84393 6.01189 7.78708 10.6828 8.01051 6.31174 5.36258 8.73972 12.3782 numMergedOcc 0
4 mol 69 unq 0 iso 0 dist 7.32268 8.24121 8.0675 8.52371 12.8766 10.149 6.51655 11.1265 7.04352 10.5996 numMergedOcc 0
5 mol 69 unq 1 iso 0 dist 7.32268 8.24121 8.0675 8.52371 12.8766 10.149 15.9496 12.5 8.1114 16.9687 numMergedOcc 0
6 mol 69 unq 2 iso 0 dist 7.32268 8.24121 8.0675 6.8198 7.98306 12.0119 6.51655 11.1265 7.04352 13.0654 numMergedOcc 0
7 mol 69 unq 3 iso 0 dist 7.32268 8.24121 8.0675 6.8198 7.98306 12.0119 15.9496 12.5 8.1114 18.2373 numMergedOcc 0
8 mol 115 unq 0 iso 0 dist 9.36674 9.56867 16.6569 7.44784 6.06198 11.5723 7.97477 14.6895 6.99777 11.695 numMergedOcc 0
9 mol 115 unq 1 iso 0 dist 9.36674 9.56867 16.6569 7.44784 6.06198 11.5723 6.58038 13.6085 9.14376 10.0603 numMergedOcc 0
10 mol 132 unq 0 iso 0 dist 7.73306 6.495 11.6877 9.43748 11.8999 4.35917 10.343 14.6742 6.03703 7.61505 numMergedOcc 0
11 mol 132 unq 1 iso 0 dist 7.73306 9.43748 11.8999 6.495 11.6877 4.35917 10.343 14.6742 7.61505 6.03703 numMergedOcc 0
12 mol 134 unq 0 iso 0 dist 8.84695 5.67862 8.44345 7.97208 7.46245 5.00817 6.30187 13.1565 5.42582 8.6355 numMergedOcc 0
13 mol 134 unq 1 iso 0 dist 8.84695 7.97208 7.46245 5.67862 8.44345 5.00817 6.30187 13.1565 8.6355 5.42582 numMergedOcc 0
14 mol 140 unq 0 iso 0 dist 9.35707 9.41832 12.5321 5.44596 11.9489 6.43459 6.92517 13.5695 6.95323 7.27371 numMergedOcc 0
15 mol 140 unq 1 iso 0 dist 9.35707 9.41832 12.5321 9.69069 4.95731 8.90548 6.92517 13.5695 6.95323 12.3335 numMergedOcc 0
16 mol 140 unq 2 iso 0 dist 9.35707 5.44596 11.9489 9.41832 12.5321 6.43459 6.92517 13.5695 7.27371 6.95323 numMergedOcc 0
17 mol 140 unq 3 iso 0 dist 9.35707 5.44596 11.9489 9.69069 4.95731 9.87462 6.92517 13.5695 7.27371 12.3335 numMergedOcc 0
18 mol 175 unq 0 iso 0 dist 9.30469 6.73365 12.0877 9.45659 9.79219 5.35493 7.92448 13.1492 9.0664 11.5506 numMergedOcc 0
19 mol 175 unq 1 iso 0 dist 9.30469 6.73365 12.0877 9.44856 5.94412 9.63234 7.92448 13.1492 9.0664 14.78 numMergedOcc 0
20 mol 219 unq 0 iso 0 dist 9.48678 8.09769 13.0834 7.24832 6.90908 7.02195 7.42613 14.4769 4.87541 10.105 numMergedOcc 0
21 mol 240 unq 0 iso 0 dist 6.87809 6.01168 6.24198 7.72928 5.90601 4.28414 6.40204 10.6028 6.15305 7.03489 numMergedOcc 0
22 mol 240 unq 1 iso 0 dist 6.87809 6.01168 6.24198 7.72928 5.90601 4.28414 11.4113 13.0048 8.0951 12.1358 numMergedOcc 0
23 mol 240 unq 2 iso 0 dist 6.87809 7.72928 5.90601 6.01168 6.24198 4.28414 6.40204 10.6028 7.03489 6.15305 numMergedOcc 0
24 mol 282 unq 0 iso 0 dist 9.06244 9.51581 7.94567 6.84554 6.17747 4.66602 10.8603 11.4162 7.32347 10.4802 numMergedOcc 0
25 mol 284 unq 0 iso 0 dist 7.78736 9.41428 15.042 7.2795 11.6982 5.87439 5.90634 11.3681 8.41504 10.0956 numMergedOcc 0
26 mol 284 unq 1 iso 0 dist 8.19742 9.41428 10.6793 7.2795 5.36955 5.87439 5.90634 12.476 8.41504 10.0956 numMergedOcc 0
