0 mol 8 unq 0 iso 0 dist 6.92865 8.89145 8.02605 6.88402 8.99126 14.849 8.95363 7.8922 13.7261 6.69972 numMergedOcc 0
1 mol 19 unq 0 iso 0 dist 7.84393 7.78708 8.01051 6.31174 8.73972 12.3782 4.93362 6.36455 10.2326 6.87842 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 6.30194 4.24428 5.7113 5.14919 4.65521 5.64598 14.8714 8.73253 13.1821 11.2505 numMergedOcc 0
3 mol 114 unq 0 iso 0 dist 8.19156 9.54589 11.5982 5.01204 6.96442 13.2753 12.0204 9.7918 19.8056 7.27945 numMergedOcc 0
4 mol 115 unq 0 iso 0 dist 9.56867 7.44784 11.5723 7.97477 6.99777 11.695 4.64486 5.74857 10.0289 6.03931 numMergedOcc 0
5 mol 115 unq 1 iso 0 dist 9.56867 7.44784 11.5723 6.58038 9.14376 10.0603 4.64486 5.74857 10.0289 5.99374 numMergedOcc 0
6 mol 134 unq 0 iso 0 dist 7.97208 5.67862 5.00817 6.30187 8.6355 5.42582 11.5403 5.53031 10.1537 11.9544 numMergedOcc 0
7 mol 204 unq 0 iso 0 dist 7.7292 6.27396 12.5143 11.695 5.90931 16.9866 12.0796 6.85441 16.2661 10.7974 numMergedOcc 0
8 mol 236 unq 0 iso 0 dist 6.36941 9.97357 7.28249 11.4732 5.34718 7.17676 7.05684 8.50331 11.9847 11.6774 numMergedOcc 0
9 mol 240 unq 0 iso 0 dist 6.01168 7.72928 4.28414 6.40204 6.15305 7.03489 14.3522 9.47583 8.44909 9.75032 numMergedOcc 0
10 mol 240 unq 1 iso 0 dist 6.01168 7.72928 4.28414 11.4113 8.0951 12.1358 14.3522 9.47583 8.44909 12.9871 numMergedOcc 0
11 mol 240 unq 2 iso 0 dist 7.72928 6.01168 4.28414 6.40204 7.03489 6.15305 14.3522 8.44909 9.47583 9.75032 numMergedOcc 0
12 mol 240 unq 3 iso 0 dist 6.83069 9.30995 4.28414 10.6805 6.15305 7.03489 8.30926 9.47583 8.44909 9.75032 numMergedOcc 0
13 mol 240 unq 4 iso 0 dist 6.83069 9.30995 4.28414 5.79056 8.0951 12.1358 8.30926 9.47583 8.44909 12.9871 numMergedOcc 0
14 mol 240 unq 5 iso 0 dist 9.30995 6.83069 4.28414 10.6805 7.03489 6.15305 8.30926 8.44909 9.47583 9.75032 numMergedOcc 0
15 mol 272 unq 0 iso 0 dist 6.62923 4.78812 5.40809 6.99865 9.09992 6.73206 14.4134 9.19033 11.9971 11.8912 numMergedOcc 0
16 mol 272 unq 1 iso 0 dist 6.62923 4.78812 5.40809 10.3424 6.16449 10.1966 14.4134 9.19033 11.9971 6.56154 numMergedOcc 0
