0 mol 16 unq 0 iso 0 dist 9.76968 4.2139 6.31718 12.1754 7.63133 10.8455 9.68387 10.4366 6.93532 16.9082 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 9.54519 13.2653 5.54419 5.80023 7.36323 12.3067 13.5984 5.59311 8.70827 9.12854 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 9.54519 13.2653 5.54419 5.80023 7.36323 12.3067 18.4559 12.176 6.73939 18.673 numMergedOcc 0
3 mol 24 unq 2 iso 0 dist 9.54519 5.80023 7.36323 13.2653 5.54419 12.3067 13.5984 5.59311 9.12854 8.70827 numMergedOcc 0
4 mol 24 unq 3 iso 0 dist 6.11056 10.4744 8.86116 6.9756 8.38394 6.44287 16.6031 14.012 9.41441 15.392 numMergedOcc 0
5 mol 25 unq 0 iso 0 dist 8.40051 13.466 7.57578 14.4191 7.17969 4.33106 8.78181 6.08585 8.50222 7.55264 numMergedOcc 0
6 mol 25 unq 1 iso 0 dist 8.40051 14.4191 7.17969 13.466 7.57578 4.33106 8.78181 6.08585 7.55264 8.50222 numMergedOcc 0
7 mol 54 unq 0 iso 0 dist 5.97635 6.76462 6.83299 10.7219 9.5589 5.08001 4.38047 4.29856 6.14538 10.6808 numMergedOcc 0
8 mol 54 unq 1 iso 0 dist 5.97635 6.76462 6.83299 13.2619 8.10861 14.2075 4.38047 4.29856 6.14538 10.4158 numMergedOcc 0
9 mol 59 unq 0 iso 0 dist 6.65344 13.1729 7.71095 5.29688 6.85766 10.0246 16.2055 9.64444 6.73347 14.8852 numMergedOcc 0
10 mol 75 unq 0 iso 0 dist 6.95595 12.7957 7.79912 10.309 8.56639 5.64643 18.3917 11.4997 9.81166 14.6043 numMergedOcc 0
11 mol 75 unq 1 iso 0 dist 6.95595 12.7957 7.79912 5.80162 8.59017 10.4899 18.3917 11.4997 9.81166 18.7078 numMergedOcc 0
12 mol 95 unq 0 iso 0 dist 9.65047 5.69671 8.03644 5.33325 7.27724 8.41707 9.49995 11.4333 9.49454 12.1092 numMergedOcc 0
13 mol 98 unq 0 iso 0 dist 5.9747 4.75138 5.08437 10.4417 6.48948 9.51923 10.9995 7.06961 6.7117 9.42961 numMergedOcc 0
14 mol 98 unq 1 iso 0 dist 5.9747 4.75138 5.08437 11.3628 6.10456 8.40073 10.9995 7.06961 6.7117 4.47349 numMergedOcc 0
15 mol 98 unq 2 iso 0 dist 5.9747 11.3628 6.10456 4.75138 5.08437 8.40073 10.9995 7.06961 4.47349 6.7117 numMergedOcc 0
16 mol 98 unq 3 iso 0 dist 5.9747 11.3628 6.10456 10.4417 6.48948 9.42358 10.9995 7.06961 4.47349 9.42961 numMergedOcc 0
17 mol 98 unq 4 iso 0 dist 4.50572 6.88489 5.08437 9.63267 6.48948 9.51923 11.1541 7.06961 6.7117 9.42961 numMergedOcc 0
18 mol 98 unq 5 iso 0 dist 4.50572 6.88489 5.08437 9.82583 6.10456 8.40073 11.1541 7.06961 6.7117 4.47349 numMergedOcc 0
19 mol 98 unq 6 iso 0 dist 4.50572 9.82583 6.10456 6.88489 5.08437 8.40073 11.1541 7.06961 4.47349 6.7117 numMergedOcc 0
20 mol 98 unq 7 iso 0 dist 4.50572 9.82583 6.10456 9.63267 6.48948 9.42358 11.1541 7.06961 4.47349 9.42961 numMergedOcc 0
21 mol 129 unq 0 iso 0 dist 6.38163 10.0961 5.83384 8.61575 9.61051 9.05135 12.672 10.7293 9.36851 16.0242 numMergedOcc 0
22 mol 129 unq 1 iso 0 dist 6.38163 10.0961 5.83384 8.61575 9.61051 9.05135 11.6466 7.29399 4.97175 13.4182 numMergedOcc 0
23 mol 131 unq 0 iso 0 dist 6.31125 5.59449 6.85062 5.6098 8.40312 10.7062 13.6954 14.2045 8.70296 18.0058 numMergedOcc 0
24 mol 131 unq 1 iso 0 dist 6.31125 5.59449 6.85062 5.6098 8.40312 10.7062 10.9811 5.09131 9.25558 13.44 numMergedOcc 0
25 mol 131 unq 2 iso 0 dist 6.31125 5.59449 6.85062 4.29914 7.12972 6.63273 13.6954 14.2045 8.70296 12.6227 numMergedOcc 0
26 mol 131 unq 3 iso 0 dist 6.31125 5.59449 6.85062 4.29914 7.12972 6.63273 10.9811 5.09131 9.25558 11.586 numMergedOcc 0
27 mol 133 unq 0 iso 0 dist 5.82404 10.2385 6.29155 4.64588 6.80239 7.81217 6.72323 4.54648 6.16242 5.87634 numMergedOcc 0
28 mol 133 unq 1 iso 0 dist 5.82404 10.2385 6.29155 5.37072 8.00618 11.965 6.72323 4.54648 6.16242 10.9061 numMergedOcc 0
29 mol 133 unq 2 iso 0 dist 5.82404 4.64588 6.80239 10.2385 6.29155 7.81217 6.72323 4.54648 5.87634 6.16242 numMergedOcc 0
30 mol 133 unq 3 iso 0 dist 5.82404 4.64588 6.80239 5.37072 8.00618 7.79672 6.72323 4.54648 5.87634 10.9061 numMergedOcc 0
31 mol 133 unq 4 iso 0 dist 5.86531 6.26797 7.11802 9.73435 8.00618 8.18495 14.2733 16.0138 9.22232 12.7901 numMergedOcc 0
32 mol 133 unq 5 iso 0 dist 5.86531 6.26797 7.11802 9.73435 8.00618 8.18495 6.42904 5.92062 9.22661 13.5028 numMergedOcc 0
33 mol 133 unq 6 iso 0 dist 5.86531 6.26797 7.11802 9.73435 8.00618 8.18495 10.0298 6.61891 7.56378 11.8433 numMergedOcc 0
34 mol 134 unq 0 iso 0 dist 9.92932 10.5108 8.94367 6.20443 9.86662 6.81259 12.1527 4.57832 6.23142 9.94764 numMergedOcc 0
35 mol 134 unq 1 iso 0 dist 9.92932 6.20443 9.86662 10.5108 8.94367 6.81259 12.1527 4.57832 9.94764 6.23142 numMergedOcc 0
36 mol 134 unq 2 iso 0 dist 9.60411 10.5108 6.37586 6.20443 9.71307 6.81259 12.1527 5.29786 6.23142 9.94764 numMergedOcc 0
37 mol 134 unq 3 iso 0 dist 9.60411 6.20443 9.71307 10.5108 6.37586 6.81259 12.1527 5.29786 9.94764 6.23142 numMergedOcc 0
38 mol 134 unq 4 iso 0 dist 9.55556 11.9294 8.94367 6.36794 9.86662 6.81259 11.9876 4.57832 6.23142 9.94764 numMergedOcc 0
39 mol 134 unq 5 iso 0 dist 9.55556 6.36794 9.86662 11.9294 8.94367 6.81259 11.9876 4.57832 9.94764 6.23142 numMergedOcc 0
40 mol 181 unq 0 iso 0 dist 9.84952 4.3158 7.81386 12.9554 7.63312 8.85576 12.7332 7.20191 9.39829 6.41453 numMergedOcc 0
41 mol 181 unq 1 iso 0 dist 9.84952 12.9554 7.63312 4.3158 7.81386 8.85576 13.401 5.63555 5.9176 10.4943 numMergedOcc 0
42 mol 181 unq 2 iso 0 dist 9.84952 12.9554 7.63312 4.3158 7.81386 8.85576 12.7332 7.20191 6.41453 9.39829 numMergedOcc 0
43 mol 205 unq 0 iso 0 dist 5.96555 10.7091 7.26832 4.6995 6.03031 7.38516 14.6151 10.3603 5.44002 12.3113 numMergedOcc 0
44 mol 205 unq 1 iso 0 dist 5.96555 10.7091 7.26832 5.87892 7.80463 13.8543 14.6151 10.3603 5.44002 17.9798 numMergedOcc 0
45 mol 229 unq 0 iso 0 dist 8.6537 8.65216 8.22528 10.7439 7.03423 5.57838 9.38362 6.65022 8.66332 11.1976 numMergedOcc 0
46 mol 258 unq 0 iso 0 dist 5.73834 6.48867 6.60405 7.52881 6.42289 7.26417 8.63176 5.63675 7.21311 11.2102 numMergedOcc 0
47 mol 259 unq 0 iso 0 dist 5.90645 10.4985 8.13497 4.62072 8.53687 10.582 13.1095 8.41846 7.98231 15.5791 numMergedOcc 0
48 mol 264 unq 0 iso 0 dist 8.43858 8.55312 6.24356 10.2215 9.361 10.3202 13.7665 7.52936 5.93616 13.2142 numMergedOcc 0
