0 mol 24 unq 0 iso 0 dist 8.13365 7.63824 9.76111 10.9159 15.9016 7.79911 numMergedOcc 0
1 mol 51 unq 0 iso 0 dist 8.99612 6.64146 4.63184 4.03892 10.2361 8.49879 numMergedOcc 0
2 mol 62 unq 0 iso 0 dist 6.56664 9.1926 9.17877 10.5761 10.9296 7.25138 numMergedOcc 0
3 mol 62 unq 1 iso 0 dist 9.58156 9.1926 13.7909 10.5761 18.1788 7.25138 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 6.04163 6.16745 3.85805 6.41257 10.7935 8.4515 numMergedOcc 0
5 mol 76 unq 0 iso 0 dist 9.32453 8.63792 3.69293 4.35001 6.4551 6.46582 numMergedOcc 0
6 mol 90 unq 0 iso 0 dist 4.75701 6.02596 4.79453 4.14427 5.9179 6.10053 numMergedOcc 0
7 mol 90 unq 1 iso 0 dist 9.89618 8.17454 4.79453 10.1669 5.9179 6.10053 numMergedOcc 0
8 mol 95 unq 0 iso 0 dist 8.13273 4.81841 4.73066 4.98105 11.5827 7.74924 numMergedOcc 0
9 mol 95 unq 1 iso 0 dist 8.29852 4.81841 4.20834 4.98105 10.9272 7.74924 numMergedOcc 0
10 mol 113 unq 0 iso 0 dist 9.57352 9.44 6.54263 15.0126 13.2795 7.96893 numMergedOcc 0
11 mol 117 unq 0 iso 0 dist 9.60425 5.94465 11.1642 8.64874 12.479 6.01857 numMergedOcc 0
12 mol 120 unq 0 iso 0 dist 8.14799 8.44206 3.35803 10.1556 7.04864 8.03124 numMergedOcc 0
13 mol 129 unq 0 iso 0 dist 7.00798 8.42277 12.7464 8.62597 13.7159 7.93106 numMergedOcc 0
14 mol 129 unq 1 iso 0 dist 7.00798 8.42277 12.7464 4.04119 10.2333 7.04904 numMergedOcc 0
15 mol 129 unq 2 iso 0 dist 7.00798 6.26653 10.1964 8.62597 13.7159 9.05575 numMergedOcc 0
16 mol 129 unq 3 iso 0 dist 7.00798 6.26653 10.1964 4.04119 10.2333 5.06053 numMergedOcc 0
17 mol 133 unq 0 iso 0 dist 6.53153 6.01995 5.81903 7.49664 10.2159 4.82356 numMergedOcc 0
18 mol 133 unq 1 iso 0 dist 6.53153 6.01995 5.81903 14.1334 13.7051 8.83476 numMergedOcc 0
19 mol 133 unq 2 iso 0 dist 6.29975 6.01995 6.12885 7.49664 9.3894 4.82356 numMergedOcc 0
20 mol 133 unq 3 iso 0 dist 6.29975 6.01995 6.12885 14.1334 14.1938 8.83476 numMergedOcc 0
21 mol 133 unq 4 iso 0 dist 8.29673 6.01995 11.0915 7.49664 14.8299 4.82356 numMergedOcc 0
22 mol 133 unq 5 iso 0 dist 8.29673 6.01995 11.0915 14.1334 19.7984 8.83476 numMergedOcc 0
23 mol 147 unq 0 iso 0 dist 9.23551 8.94352 12.7148 10.7499 14.5535 8.76449 numMergedOcc 0
24 mol 185 unq 0 iso 0 dist 6.62848 8.60009 8.09496 11.8032 13.8686 8.07469 numMergedOcc 0
25 mol 204 unq 0 iso 0 dist 9.66975 9.38235 14.5003 3.95188 12.6793 8.49554 numMergedOcc 0
26 mol 204 unq 1 iso 0 dist 9.66975 9.38235 14.5003 4.92057 14.3831 8.29256 numMergedOcc 0
27 mol 204 unq 2 iso 0 dist 9.66975 8.95509 14.597 4.92057 14.3831 7.8274 numMergedOcc 0
28 mol 210 unq 0 iso 0 dist 7.86668 8.20259 9.97638 4.04112 8.62103 9.49242 numMergedOcc 0
29 mol 220 unq 0 iso 0 dist 5.71825 6.23243 3.57917 4.12315 7.75084 7.45831 numMergedOcc 0
