0 mol 7 unq 0 iso 0 dist 8.19144 5.77391 7.31201 11.1673 9.55056 5.44992 11.9671 10.789 7.10621 5.72491 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.19144 5.77391 7.31201 8.71528 7.57354 4.74523 11.9671 10.789 7.10621 9.67579 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 7.84459 10.3415 7.31201 14.7203 9.55056 5.44992 16.4849 10.789 7.10621 5.72491 numMergedOcc 0
3 mol 7 unq 3 iso 0 dist 7.84459 10.3415 7.31201 10.8725 7.57354 4.74523 16.4849 10.789 7.10621 9.67579 numMergedOcc 0
4 mol 26 unq 0 iso 0 dist 9.10253 16.9524 9.16962 9.0552 9.25649 17.7956 18.0965 11.887 8.34347 17.0926 numMergedOcc 0
5 mol 26 unq 1 iso 0 dist 9.10253 16.9524 9.16962 6.32148 9.36104 15.23 18.0965 11.887 8.34347 13.664 numMergedOcc 0
6 mol 75 unq 0 iso 0 dist 7.49283 9.14798 5.15851 8.87463 9.48876 9.12189 16.1633 10.0425 7.79912 12.5982 numMergedOcc 0
7 mol 75 unq 1 iso 0 dist 7.49283 9.14798 5.15851 8.87463 9.48876 9.12189 17.6145 11.8774 8.56639 16.199 numMergedOcc 0
8 mol 75 unq 2 iso 0 dist 7.49283 9.14798 5.15851 8.87463 9.48876 9.12189 15.3522 10.0372 8.59017 17.5874 numMergedOcc 0
9 mol 92 unq 0 iso 0 dist 6.58062 11.1785 5.81965 12.0489 9.28578 5.7134 11.1915 6.99832 7.4729 12.3604 numMergedOcc 0
10 mol 92 unq 1 iso 0 dist 6.58062 10.8489 9.70512 12.0489 9.28578 10.7874 11.1915 6.99832 6.82344 12.3604 numMergedOcc 0
11 mol 115 unq 0 iso 0 dist 6.87582 7.12329 6.99777 5.15368 9.9928 7.3094 12.5786 10.8292 6.11741 10.9734 numMergedOcc 0
12 mol 115 unq 1 iso 0 dist 6.87582 7.12329 6.99777 5.15368 9.9928 7.3094 9.93482 11.7126 7.88312 5.72642 numMergedOcc 0
13 mol 115 unq 2 iso 0 dist 8.77794 5.19652 6.99777 11.9046 9.9928 7.3094 8.97043 10.8292 6.11741 10.9734 numMergedOcc 0
14 mol 115 unq 3 iso 0 dist 8.77794 5.19652 6.99777 11.9046 9.9928 7.3094 12.9647 11.7126 7.88312 5.72642 numMergedOcc 0
15 mol 130 unq 0 iso 0 dist 6.16039 9.86628 6.89257 7.14836 6.42785 5.97111 13.6645 8.84655 8.70949 8.33077 numMergedOcc 0
16 mol 130 unq 1 iso 0 dist 6.16039 9.86628 6.89257 11.923 6.82089 6.97875 13.6645 8.84655 8.70949 10.3572 numMergedOcc 0
17 mol 175 unq 0 iso 0 dist 9.15536 10.5343 9.31887 14.8807 7.01126 13.9336 17.5589 11.0415 9.0018 12.6297 numMergedOcc 0
18 mol 175 unq 1 iso 0 dist 9.15536 10.5343 9.31887 14.8807 7.01126 13.9336 11.5905 5.0384 7.652 10.1905 numMergedOcc 0
19 mol 175 unq 2 iso 0 dist 9.15536 10.5343 9.31887 9.37871 6.58434 11.873 17.5589 11.0415 9.0018 15.2721 numMergedOcc 0
20 mol 175 unq 3 iso 0 dist 9.15536 10.5343 9.31887 9.37871 6.58434 11.873 11.5905 5.0384 7.652 11.1503 numMergedOcc 0
21 mol 181 unq 0 iso 0 dist 9.7281 7.07865 7.37327 15.7969 7.96291 9.92777 9.79901 11.1462 7.81386 14.3453 numMergedOcc 0
22 mol 181 unq 1 iso 0 dist 9.7281 7.07865 7.37327 15.7969 7.96291 9.92777 13.7928 13.3389 7.63312 11.6558 numMergedOcc 0
23 mol 205 unq 0 iso 0 dist 7.70781 10.6362 9.19704 10.142 9.83885 5.54129 12.9169 8.66809 6.03031 10.8209 numMergedOcc 0
24 mol 205 unq 1 iso 0 dist 7.70781 10.6362 9.19704 10.142 9.83885 5.54129 6.15806 6.23291 7.26832 10.0424 numMergedOcc 0
25 mol 205 unq 2 iso 0 dist 7.70781 10.6362 9.19704 10.142 9.83885 5.54129 17.5925 13.231 7.80463 10.03 numMergedOcc 0
26 mol 205 unq 3 iso 0 dist 7.70781 10.6362 9.19704 6.37333 5.42696 5.28092 12.9169 8.66809 6.03031 8.44861 numMergedOcc 0
27 mol 205 unq 4 iso 0 dist 7.70781 10.6362 9.19704 6.37333 5.42696 5.28092 6.15806 6.23291 7.26832 5.60393 numMergedOcc 0
28 mol 205 unq 5 iso 0 dist 7.70781 10.6362 9.19704 6.37333 5.42696 5.28092 17.5925 13.231 7.80463 11.3521 numMergedOcc 0
29 mol 214 unq 0 iso 0 dist 5.77917 7.05305 7.46831 6.23657 5.10114 5.63388 11.3827 6.67959 8.85478 6.38157 numMergedOcc 0
30 mol 239 unq 0 iso 0 dist 8.5166 9.78463 7.39747 5.71442 7.18771 5.66732 13.742 6.26168 7.00034 10.2163 numMergedOcc 0
31 mol 294 unq 0 iso 0 dist 9.17225 5.57044 9.03492 6.60365 8.32473 5.25615 5.18789 6.17102 8.15665 9.13907 numMergedOcc 0
