0 mol 7 unq 0 iso 0 dist 9.8603 16.6461 9.67164 20.1827 10.515 8.81608 13.8384 5.72491 8.0744 7.45262 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 9.8603 16.6461 9.67164 20.1827 10.515 8.81608 17.8433 9.67579 11.7002 6.96586 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 5.51421 4.7739 5.99459 10.9688 6.06176 8.81608 10.3237 7.88043 8.0744 7.45262 numMergedOcc 0
3 mol 7 unq 3 iso 0 dist 5.51421 4.7739 5.99459 10.9688 6.06176 8.81608 13 8.80762 11.7002 6.96586 numMergedOcc 0
4 mol 25 unq 0 iso 0 dist 8.40051 13.591 9.48085 12.5693 12.1492 8.53931 13.3963 16.357 11.7199 8.5404 numMergedOcc 0
5 mol 25 unq 1 iso 0 dist 8.6396 13.591 9.49421 12.5693 4.70708 8.53931 13.3963 6.6492 11.7199 8.5404 numMergedOcc 0
6 mol 62 unq 0 iso 0 dist 8.1599 5.46563 6.9103 8.84323 5.49555 9.1062 5.0413 10.9202 6.35287 9.87677 numMergedOcc 0
7 mol 119 unq 0 iso 0 dist 6.18763 5.92411 8.95212 10.2497 10.3457 6.13374 9.79485 14.6439 6.29394 9.87025 numMergedOcc 0
8 mol 119 unq 1 iso 0 dist 6.18763 5.92411 8.95212 13.4009 16.7975 9.08536 18.48 22.1873 13.2984 9.05798 numMergedOcc 0
9 mol 119 unq 2 iso 0 dist 6.18763 5.92411 8.95212 13.4009 16.7975 9.08536 9.79485 14.6439 6.29394 5.85818 numMergedOcc 0
10 mol 119 unq 3 iso 0 dist 8.44385 5.92411 6.99446 10.2497 6.35763 6.13374 9.79485 7.99857 6.29394 9.87025 numMergedOcc 0
11 mol 119 unq 4 iso 0 dist 8.44385 5.92411 6.99446 13.4009 7.36192 9.08536 18.48 15.5802 13.2984 9.05798 numMergedOcc 0
12 mol 119 unq 5 iso 0 dist 8.44385 5.92411 6.99446 13.4009 7.36192 9.08536 9.79485 7.99857 6.29394 5.85818 numMergedOcc 0
13 mol 119 unq 6 iso 0 dist 5.63005 5.92411 7.64052 10.2497 10.0197 6.13374 9.79485 8.56342 6.29394 9.87025 numMergedOcc 0
14 mol 119 unq 7 iso 0 dist 5.63005 5.92411 7.64052 13.4009 10.6679 9.08536 18.48 17.7572 13.2984 9.05798 numMergedOcc 0
15 mol 119 unq 8 iso 0 dist 5.63005 5.92411 7.64052 13.4009 10.6679 9.08536 9.79485 8.56342 6.29394 5.85818 numMergedOcc 0
16 mol 133 unq 0 iso 0 dist 5.82404 11.5628 8.77023 15.0113 9.53782 8.55349 20.0515 15.7571 9.82696 8.07135 numMergedOcc 0
17 mol 143 unq 0 iso 0 dist 8.30654 9.60065 7.36975 11.674 6.01455 7.05845 6.49958 7.63338 3.75378 8.1582 numMergedOcc 0
18 mol 143 unq 1 iso 0 dist 8.30654 9.60065 7.36975 11.674 6.01455 7.05845 5.82537 7.25673 9.30534 7.88655 numMergedOcc 0
19 mol 143 unq 2 iso 0 dist 8.30654 9.60065 7.36975 10.2332 5.44503 8.18023 6.29937 8.41611 9.05786 6.40901 numMergedOcc 0
20 mol 143 unq 3 iso 0 dist 8.30654 9.60065 7.36975 10.2332 5.44503 8.18023 6.49958 7.63338 3.75378 9.40626 numMergedOcc 0
21 mol 143 unq 4 iso 0 dist 8.30654 4.68518 5.40637 10.2332 5.44503 7.46803 6.29937 8.41611 6.16103 6.40901 numMergedOcc 0
22 mol 143 unq 5 iso 0 dist 8.30654 4.68518 5.40637 10.2332 5.44503 7.46803 6.49958 7.63338 8.4697 9.40626 numMergedOcc 0
23 mol 197 unq 0 iso 0 dist 8.3337 17.2264 9.10817 10.7619 5.2908 9.27218 14.8335 13.1911 15.0713 9.71865 numMergedOcc 0
24 mol 214 unq 0 iso 0 dist 9.51764 14.8375 7.46481 11.3587 6.67959 8.70987 10.5029 6.38157 5.73082 5.10114 numMergedOcc 0
25 mol 214 unq 1 iso 0 dist 5.36829 5.47184 7.46481 10.5513 6.67959 8.70987 8.38755 6.38157 5.73082 5.10114 numMergedOcc 0
26 mol 234 unq 0 iso 0 dist 7.86368 9.8663 7.81215 16.337 12.1076 7.20293 20.0334 13.7892 11.7392 9.06084 numMergedOcc 0
27 mol 259 unq 0 iso 0 dist 9.54857 5.49348 5.85442 10.5864 5.79468 6.23661 12.7168 8.55558 7.32929 6.39918 numMergedOcc 0
28 mol 259 unq 1 iso 0 dist 6.42725 11.761 8.03219 8.65525 5.31048 8.84648 12.2782 8.59697 4.67584 6.39918 numMergedOcc 0
29 mol 259 unq 2 iso 0 dist 6.42725 6.09466 6.9899 8.65525 5.31048 6.23661 12.2782 8.59697 7.32929 6.39918 numMergedOcc 0
