0 mol 7 unq 0 iso 0 dist 9.60499 6.02702 8.43473 11.8172 11.0773 8.72114 15.9584 13.2603 9.97624 10.515 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 7.10621 8.72114 13.8829 11.8172 18.3807 6.02702 10.515 9.36807 9.97624 15.9584 numMergedOcc 0
2 mol 15 unq 0 iso 0 dist 8.38064 7.48342 4.39605 11.7498 10.6338 6.42748 6.29685 10.2062 6.50647 6.67334 numMergedOcc 0
3 mol 15 unq 1 iso 0 dist 9.97507 7.48342 12.1303 11.7498 18.3783 6.42748 6.29685 15.3099 6.50647 6.67334 numMergedOcc 0
4 mol 19 unq 0 iso 0 dist 7.20519 7.75618 4.96411 7.67038 10.4091 8.40416 5.5841 9.80108 7.02548 6.74265 numMergedOcc 0
5 mol 19 unq 1 iso 0 dist 8.4674 8.40416 9.74255 7.67038 4.54938 7.75618 6.74265 9.58539 7.02548 5.5841 numMergedOcc 0
6 mol 19 unq 2 iso 0 dist 8.4674 6.41575 4.64838 5.80928 4.51865 6.41423 5.14627 6.20943 5.82366 4.69858 numMergedOcc 0
7 mol 19 unq 3 iso 0 dist 4.54938 7.75618 9.74255 7.67038 8.4674 8.40416 5.5841 9.58539 7.02548 6.74265 numMergedOcc 0
8 mol 19 unq 4 iso 0 dist 4.54938 6.41575 4.97119 5.80928 6.864 6.41423 5.14627 7.82528 5.82366 4.69858 numMergedOcc 0
9 mol 19 unq 5 iso 0 dist 7.82074 6.41575 6.01808 5.80928 11.0366 6.41423 5.14627 10.2708 5.82366 4.69858 numMergedOcc 0
10 mol 19 unq 6 iso 0 dist 4.51865 8.40416 7.08342 7.67038 6.864 7.75618 6.74265 8.58657 7.02548 5.5841 numMergedOcc 0
11 mol 19 unq 7 iso 0 dist 4.51865 6.41423 4.64838 5.80928 8.4674 6.41575 4.69858 6.20943 5.82366 5.14627 numMergedOcc 0
12 mol 19 unq 8 iso 0 dist 6.864 7.75618 7.08342 7.67038 4.51865 8.40416 5.5841 8.58657 7.02548 6.74265 numMergedOcc 0
13 mol 19 unq 9 iso 0 dist 6.864 6.41423 4.97119 5.80928 4.54938 6.41575 4.69858 7.82528 5.82366 5.14627 numMergedOcc 0
14 mol 98 unq 0 iso 0 dist 5.08437 6.7117 7.06961 8.40073 6.10456 4.47349 8.70415 10.417 6.0129 10.0962 numMergedOcc 0
15 mol 98 unq 1 iso 0 dist 5.08437 6.7117 7.06961 10.2427 10.1136 5.65185 8.70415 10.417 6.0129 11.2452 numMergedOcc 0
16 mol 98 unq 2 iso 0 dist 6.10456 4.47349 7.06961 8.40073 5.08437 6.7117 10.0962 10.417 6.0129 8.70415 numMergedOcc 0
17 mol 98 unq 3 iso 0 dist 6.10456 4.47349 7.06961 5.02887 10.1136 5.65185 10.0962 10.417 6.0129 11.2452 numMergedOcc 0
18 mol 134 unq 0 iso 0 dist 9.89303 7.69991 4.60632 5.00526 9.93925 6.23142 6.69989 12.7291 8.55616 5.3585 numMergedOcc 0
19 mol 134 unq 1 iso 0 dist 9.89303 7.69991 4.60632 5.00526 9.93925 6.23142 10.1448 12.0514 8.73604 5.41704 numMergedOcc 0
20 mol 134 unq 2 iso 0 dist 9.89303 7.69991 4.60632 11.3271 14.423 9.94764 6.69989 12.7291 8.55616 6.74887 numMergedOcc 0
21 mol 134 unq 3 iso 0 dist 9.89303 7.69991 4.60632 11.3271 14.423 9.94764 10.1448 12.0514 8.73604 6.17103 numMergedOcc 0
22 mol 134 unq 4 iso 0 dist 6.54501 7.69991 5.71679 5.00526 6.49416 6.23142 6.69989 10.9685 8.55616 5.3585 numMergedOcc 0
23 mol 134 unq 5 iso 0 dist 6.54501 7.69991 5.71679 5.00526 6.49416 6.23142 10.1448 8.6355 8.73604 5.41704 numMergedOcc 0
24 mol 134 unq 6 iso 0 dist 6.54501 7.69991 5.71679 11.3271 12.5075 9.94764 6.69989 10.9685 8.55616 6.74887 numMergedOcc 0
25 mol 134 unq 7 iso 0 dist 6.54501 7.69991 5.71679 11.3271 12.5075 9.94764 10.1448 8.6355 8.73604 6.17103 numMergedOcc 0
26 mol 134 unq 8 iso 0 dist 8.94367 6.23142 4.57832 5.00526 11.9139 7.69991 5.3585 11.2292 8.55616 6.69989 numMergedOcc 0
27 mol 134 unq 9 iso 0 dist 8.94367 6.23142 4.57832 5.00526 11.9139 7.69991 5.41704 8.79571 8.73604 10.1448 numMergedOcc 0
28 mol 134 unq 10 iso 0 dist 8.94367 6.23142 4.57832 6.81259 9.86662 9.94764 5.3585 11.2292 8.55616 6.74887 numMergedOcc 0
29 mol 134 unq 11 iso 0 dist 8.94367 6.23142 4.57832 6.81259 9.86662 9.94764 5.41704 8.79571 8.73604 6.17103 numMergedOcc 0
30 mol 134 unq 12 iso 0 dist 6.37586 6.23142 5.29786 5.00526 9.5126 7.69991 5.3585 10.9613 8.55616 6.69989 numMergedOcc 0
31 mol 134 unq 13 iso 0 dist 6.37586 6.23142 5.29786 5.00526 9.5126 7.69991 5.41704 5.42582 8.73604 10.1448 numMergedOcc 0
32 mol 134 unq 14 iso 0 dist 6.37586 6.23142 5.29786 6.81259 9.71307 9.94764 5.3585 10.9613 8.55616 6.74887 numMergedOcc 0
33 mol 134 unq 15 iso 0 dist 6.37586 6.23142 5.29786 6.81259 9.71307 9.94764 5.41704 5.42582 8.73604 6.17103 numMergedOcc 0
34 mol 134 unq 16 iso 0 dist 6.49416 6.23142 5.71679 5.00526 6.54501 7.69991 5.3585 10.9685 8.55616 6.69989 numMergedOcc 0
35 mol 134 unq 17 iso 0 dist 6.49416 6.23142 5.71679 5.00526 6.54501 7.69991 5.41704 8.6355 8.73604 10.1448 numMergedOcc 0
36 mol 134 unq 18 iso 0 dist 6.49416 6.23142 5.71679 6.81259 12.5075 9.94764 5.3585 10.9685 8.55616 6.74887 numMergedOcc 0
37 mol 134 unq 19 iso 0 dist 6.49416 6.23142 5.71679 6.81259 12.5075 9.94764 5.41704 8.6355 8.73604 6.17103 numMergedOcc 0
38 mol 134 unq 20 iso 0 dist 9.86662 9.94764 4.57832 11.3271 11.9139 7.69991 6.74887 11.2292 8.55616 6.69989 numMergedOcc 0
39 mol 134 unq 21 iso 0 dist 9.86662 9.94764 4.57832 11.3271 11.9139 7.69991 6.17103 8.79571 8.73604 10.1448 numMergedOcc 0
40 mol 134 unq 22 iso 0 dist 9.86662 9.94764 4.57832 6.81259 8.94367 6.23142 6.74887 11.2292 8.55616 5.3585 numMergedOcc 0
41 mol 134 unq 23 iso 0 dist 9.86662 9.94764 4.57832 6.81259 8.94367 6.23142 6.17103 8.79571 8.73604 5.41704 numMergedOcc 0
42 mol 134 unq 24 iso 0 dist 9.71307 9.94764 5.29786 11.3271 9.5126 7.69991 6.74887 10.9613 8.55616 6.69989 numMergedOcc 0
43 mol 134 unq 25 iso 0 dist 9.71307 9.94764 5.29786 11.3271 9.5126 7.69991 6.17103 5.42582 8.73604 10.1448 numMergedOcc 0
44 mol 134 unq 26 iso 0 dist 9.71307 9.94764 5.29786 6.81259 6.37586 6.23142 6.74887 10.9613 8.55616 5.3585 numMergedOcc 0
45 mol 134 unq 27 iso 0 dist 9.71307 9.94764 5.29786 6.81259 6.37586 6.23142 6.17103 5.42582 8.73604 5.41704 numMergedOcc 0
46 mol 156 unq 0 iso 0 dist 7.44554 9.44367 5.4555 5.56175 8.94056 7.90267 7.29758 6.27641 5.81122 8.67156 numMergedOcc 0
47 mol 156 unq 1 iso 0 dist 7.66148 7.90267 6.03934 5.56175 12.0598 9.44367 8.67156 10.9818 5.81122 7.29758 numMergedOcc 0
48 mol 156 unq 2 iso 0 dist 8.94056 7.90267 5.4555 5.56175 7.44554 9.44367 8.67156 6.27641 5.81122 7.29758 numMergedOcc 0
49 mol 181 unq 0 iso 0 dist 9.1374 6.2479 6.6251 6.01247 9.94371 6.22122 6.25083 6.94688 9.06217 10.5753 numMergedOcc 0
50 mol 181 unq 1 iso 0 dist 9.1374 6.2479 6.6251 6.01247 9.94371 6.22122 4.77278 6.71012 7.13252 5.88819 numMergedOcc 0
51 mol 181 unq 2 iso 0 dist 9.1374 6.2479 6.6251 8.88798 5.98885 7.99195 6.25083 6.94688 9.06217 5.86342 numMergedOcc 0
52 mol 181 unq 3 iso 0 dist 9.1374 6.2479 6.6251 8.88798 5.98885 7.99195 4.77278 6.71012 7.13252 9.14057 numMergedOcc 0
53 mol 181 unq 4 iso 0 dist 8.03334 6.2479 7.81713 6.01247 10.9639 6.22122 6.25083 12.1309 9.06217 10.5753 numMergedOcc 0
54 mol 181 unq 5 iso 0 dist 8.03334 6.2479 7.81713 6.01247 10.9639 6.22122 4.77278 12.2058 7.13252 5.88819 numMergedOcc 0
55 mol 181 unq 6 iso 0 dist 8.03334 6.2479 7.81713 8.88798 10.7062 7.99195 6.25083 12.1309 9.06217 5.86342 numMergedOcc 0
56 mol 181 unq 7 iso 0 dist 8.03334 6.2479 7.81713 8.88798 10.7062 7.99195 4.77278 12.2058 7.13252 9.14057 numMergedOcc 0
57 mol 181 unq 8 iso 0 dist 5.98885 7.99195 6.6251 8.88798 9.1374 6.2479 5.86342 6.94688 9.06217 6.25083 numMergedOcc 0
58 mol 181 unq 9 iso 0 dist 5.98885 7.99195 6.6251 8.88798 9.1374 6.2479 9.14057 6.71012 7.13252 4.77278 numMergedOcc 0
59 mol 181 unq 10 iso 0 dist 5.98885 7.99195 6.6251 12.6324 9.94371 6.22122 5.86342 6.94688 9.06217 10.5753 numMergedOcc 0
60 mol 181 unq 11 iso 0 dist 5.98885 7.99195 6.6251 12.6324 9.94371 6.22122 9.14057 6.71012 7.13252 5.88819 numMergedOcc 0
61 mol 181 unq 12 iso 0 dist 9.09537 7.99195 10.09 8.88798 15.0228 6.2479 5.86342 14.4632 9.06217 6.25083 numMergedOcc 0
62 mol 181 unq 13 iso 0 dist 9.09537 7.99195 10.09 8.88798 15.0228 6.2479 9.14057 15.4777 7.13252 4.77278 numMergedOcc 0
63 mol 181 unq 14 iso 0 dist 9.09537 7.99195 10.09 12.6324 16.2058 6.22122 5.86342 14.4632 9.06217 10.5753 numMergedOcc 0
64 mol 181 unq 15 iso 0 dist 9.09537 7.99195 10.09 12.6324 16.2058 6.22122 9.14057 15.4777 7.13252 5.88819 numMergedOcc 0
65 mol 186 unq 0 iso 0 dist 7.54065 8.73217 11.7429 14.5862 16.3985 7.76163 11.7299 17.7634 9.84492 10.5203 numMergedOcc 0
66 mol 232 unq 0 iso 0 dist 8.27212 9.40808 4.9377 6.56633 10.5803 8.50102 13.5597 11.4727 7.17337 8.78722 numMergedOcc 0
67 mol 235 unq 0 iso 0 dist 5.4638 9.55668 7.60081 9.89669 11.3258 6.95126 4.65302 8.21247 7.95766 6.43692 numMergedOcc 0
68 mol 238 unq 0 iso 0 dist 5.72887 9.24557 14.7883 10.0191 13.5431 7.57812 11.0401 14.1514 8.90076 5.11565 numMergedOcc 0
69 mol 238 unq 1 iso 0 dist 5.72887 9.24557 14.7883 10.0191 13.5431 7.57812 8.85181 13.9989 6.87131 13.0842 numMergedOcc 0
70 mol 238 unq 2 iso 0 dist 5.72887 9.24557 14.7883 10.0191 13.5431 7.57812 11.9142 16.5748 8.09718 13.171 numMergedOcc 0
71 mol 259 unq 0 iso 0 dist 8.13497 7.98231 8.41846 6.96053 10.3935 7.08526 11.6195 10.9591 8.71497 5.79468 numMergedOcc 0
72 mol 259 unq 1 iso 0 dist 7.88519 7.98231 8.81835 6.96053 7.46176 7.08526 11.6195 7.48005 8.71497 5.79468 numMergedOcc 0
73 mol 259 unq 2 iso 0 dist 7.46176 7.08526 8.81835 6.96053 7.88519 7.98231 5.79468 7.48005 8.71497 11.6195 numMergedOcc 0
