0 mol 1 unq 0 iso 0 dist 5.65716 4.36042 8.26708 6.44928 6.09918 5.92202 12.2921 8.31812 12.3378 10.1354 numMergedOcc 0
1 mol 1 unq 0 iso 1 dist 5.65716 6.44928 6.09918 4.36042 8.26708 5.92202 12.2921 8.31812 10.1354 12.3378 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 8.70141 13.2653 4.93188 5.80023 9.24958 12.3067 9.42167 4.87192 7.6222 11.7026 numMergedOcc 0
3 mol 24 unq 0 iso 1 dist 8.70141 5.80023 9.24958 13.2653 4.93188 12.3067 9.42167 4.87192 11.7026 7.6222 numMergedOcc 0
4 mol 25 unq 0 iso 0 dist 5.97432 6.17631 5.81959 5.59268 6.90155 10.6808 4.11406 5.44124 5.52519 7.19007 numMergedOcc 0
5 mol 25 unq 0 iso 1 dist 5.97432 5.59268 6.90155 6.17631 5.81959 10.6808 4.11406 5.44124 7.19007 5.52519 numMergedOcc 0
6 mol 148 unq 0 iso 0 dist 5.06687 5.59872 9.02318 9.27313 9.74542 6.83844 3.78181 6.49708 5.29844 6.55924 numMergedOcc 0
7 mol 148 unq 0 iso 1 dist 5.06687 9.27313 9.74542 5.59872 9.02318 6.83844 3.78181 6.49708 6.55924 5.29844 numMergedOcc 0
8 mol 148 unq 1 iso 0 dist 5.06687 5.59872 9.02318 8.61198 7.97543 7.26616 3.78181 6.49708 5.29844 9.61708 numMergedOcc 0
9 mol 148 unq 1 iso 1 dist 5.06687 8.61198 7.97543 5.59872 9.02318 7.26616 3.78181 6.49708 9.61708 5.29844 numMergedOcc 0
10 mol 148 unq 1 iso 0 dist 5.06687 9.27313 9.74542 8.61198 7.97543 8.72919 3.78181 6.49708 6.55924 9.61708 numMergedOcc 0
11 mol 148 unq 1 iso 1 dist 5.06687 8.61198 7.97543 9.27313 9.74542 8.72919 3.78181 6.49708 9.61708 6.55924 numMergedOcc 0
12 mol 150 unq 0 iso 0 dist 5.09809 9.25213 9.6606 8.68422 7.85526 8.77324 3.72958 6.45018 6.62435 9.72618 numMergedOcc 0
13 mol 150 unq 0 iso 1 dist 5.09809 8.68422 7.85526 9.25213 9.6606 8.77324 3.72958 6.45018 9.72618 6.62435 numMergedOcc 0
14 mol 150 unq 1 iso 0 dist 5.09809 9.25213 9.6606 5.56996 8.94552 6.98865 3.72958 6.45018 6.62435 5.50847 numMergedOcc 0
15 mol 150 unq 1 iso 1 dist 5.09809 5.56996 8.94552 9.25213 9.6606 6.98865 3.72958 6.45018 5.50847 6.62435 numMergedOcc 0
16 mol 150 unq 1 iso 0 dist 5.09809 8.68422 7.85526 5.56996 8.94552 7.24908 3.72958 6.45018 9.72618 5.50847 numMergedOcc 0
17 mol 150 unq 1 iso 1 dist 5.09809 5.56996 8.94552 8.68422 7.85526 7.24908 3.72958 6.45018 5.50847 9.72618 numMergedOcc 0
18 mol 194 unq 0 iso 0 dist 7.47107 10.2633 6.26839 9.36943 8.12346 8.0179 9.86028 7.39369 11.1912 6.11279 numMergedOcc 0
19 mol 194 unq 0 iso 1 dist 7.47107 9.36943 8.12346 10.2633 6.26839 8.0179 9.86028 7.39369 6.11279 11.1912 numMergedOcc 0
20 mol 194 unq 1 iso 0 dist 7.47107 10.2633 6.26839 7.72655 8.83356 14.6506 9.86028 7.39369 11.1912 9.99597 numMergedOcc 0
21 mol 194 unq 1 iso 1 dist 7.47107 7.72655 8.83356 10.2633 6.26839 14.6506 9.86028 7.39369 9.99597 11.1912 numMergedOcc 0
22 mol 194 unq 2 iso 0 dist 7.47107 10.2633 6.26839 4.57265 8.2654 8.48054 9.86028 7.39369 11.1912 9.50345 numMergedOcc 0
23 mol 194 unq 2 iso 1 dist 7.47107 4.57265 8.2654 10.2633 6.26839 8.48054 9.86028 7.39369 9.50345 11.1912 numMergedOcc 0
24 mol 194 unq 1 iso 0 dist 7.47107 9.36943 8.12346 7.72655 8.83356 13.5632 9.86028 7.39369 6.11279 9.99597 numMergedOcc 0
25 mol 194 unq 1 iso 1 dist 7.47107 7.72655 8.83356 9.36943 8.12346 13.5632 9.86028 7.39369 9.99597 6.11279 numMergedOcc 0
26 mol 194 unq 2 iso 0 dist 7.47107 9.36943 8.12346 4.57265 8.2654 6.26298 9.86028 7.39369 6.11279 9.50345 numMergedOcc 0
27 mol 194 unq 2 iso 1 dist 7.47107 4.57265 8.2654 9.36943 8.12346 6.26298 9.86028 7.39369 9.50345 6.11279 numMergedOcc 0
28 mol 194 unq 2 iso 0 dist 7.47107 7.72655 8.83356 4.57265 8.2654 11.6097 9.86028 7.39369 9.99597 9.50345 numMergedOcc 0
29 mol 194 unq 2 iso 1 dist 7.47107 4.57265 8.2654 7.72655 8.83356 11.6097 9.86028 7.39369 9.50345 9.99597 numMergedOcc 0
30 mol 227 unq 0 iso 0 dist 8.12518 12.3465 8.38865 7.2593 5.4694 5.22356 10.394 7.14633 6.21901 6.29394 numMergedOcc 0
31 mol 227 unq 0 iso 1 dist 8.12518 7.2593 5.4694 12.3465 8.38865 5.22356 10.394 7.14633 6.29394 6.21901 numMergedOcc 0
32 mol 227 unq 1 iso 0 dist 8.12518 12.3465 8.38865 7.2593 5.4694 5.22356 12.4845 9.94302 13.798 10.9445 numMergedOcc 0
33 mol 227 unq 1 iso 1 dist 8.12518 7.2593 5.4694 12.3465 8.38865 5.22356 12.4845 9.94302 10.9445 13.798 numMergedOcc 0
34 mol 240 unq 0 iso 0 dist 8.44671 15.9853 9.47583 13.1893 8.44909 4.28414 10.8851 7.35934 11.6095 11.9494 numMergedOcc 0
35 mol 240 unq 0 iso 1 dist 8.44671 13.1893 8.44909 15.9853 9.47583 4.28414 10.8851 7.35934 11.9494 11.6095 numMergedOcc 0
36 mol 252 unq 0 iso 0 dist 9.81593 8.32163 8.47784 10.6815 8.66469 13.2361 4.28835 6.77555 7.15243 7.18984 numMergedOcc 0
37 mol 252 unq 0 iso 1 dist 9.81593 10.6815 8.66469 8.32163 8.47784 13.2361 4.28835 6.77555 7.18984 7.15243 numMergedOcc 0
38 mol 252 unq 1 iso 0 dist 9.78248 16.5062 8.47784 9.67333 8.66469 13.2361 13.9287 6.77555 7.15243 7.18984 numMergedOcc 0
39 mol 252 unq 1 iso 1 dist 9.78248 9.67333 8.66469 16.5062 8.47784 13.2361 13.9287 6.77555 7.18984 7.15243 numMergedOcc 0
40 mol 258 unq 0 iso 0 dist 8.78354 11.5659 6.70815 11.716 7.99477 7.26417 4.41915 8.65191 9.34197 8.40328 numMergedOcc 0
41 mol 258 unq 0 iso 1 dist 8.78354 11.716 7.99477 11.5659 6.70815 7.26417 4.41915 8.65191 8.40328 9.34197 numMergedOcc 0
