0 mol 15 unq 0 iso 0 dist 6.42748 11.7498 7.48342 6.67334 6.50647 6.29685 4.22652 6.31608 12.2746 8.47464 numMergedOcc 0
1 mol 15 unq 0 iso 1 dist 7.48342 11.7498 6.42748 6.29685 6.50647 6.67334 12.2746 6.31608 4.22652 8.47464 numMergedOcc 0
2 mol 62 unq 0 iso 0 dist 7.56205 8.62608 4.74544 11.7069 6.04903 5.49555 14.3608 8.21895 5.9487 5.27573 numMergedOcc 0
3 mol 62 unq 0 iso 1 dist 4.74544 8.62608 7.56205 5.49555 6.04903 11.7069 5.9487 8.21895 14.3608 5.27573 numMergedOcc 0
4 mol 135 unq 0 iso 0 dist 5.62052 6.57193 7.85645 4.91422 9.15377 6.35261 3.78012 8.72359 9.62654 5.16099 numMergedOcc 0
5 mol 135 unq 0 iso 1 dist 7.85645 6.57193 5.62052 6.35261 9.15377 4.91422 9.62654 8.72359 3.78012 5.16099 numMergedOcc 0
6 mol 135 unq 1 iso 0 dist 5.62052 6.57193 7.85645 4.91422 9.15377 6.35261 10.9403 7.02963 8.06169 12.1938 numMergedOcc 0
7 mol 135 unq 1 iso 1 dist 7.85645 6.57193 5.62052 6.35261 9.15377 4.91422 8.06169 7.02963 10.9403 12.1938 numMergedOcc 0
8 mol 146 unq 0 iso 0 dist 8.84535 9.83507 8.82188 14.7359 9.44952 7.00857 10.4935 5.95148 4.19745 6.19717 numMergedOcc 0
9 mol 146 unq 0 iso 1 dist 8.82188 9.83507 8.84535 7.00857 9.44952 14.7359 4.19745 5.95148 10.4935 6.19717 numMergedOcc 0
10 mol 148 unq 0 iso 0 dist 9.91993 5.99954 9.99156 10.2478 8.73468 6.84291 4.73245 9.17462 5.38701 10.8312 numMergedOcc 0
11 mol 148 unq 0 iso 1 dist 9.99156 5.99954 9.91993 6.84291 8.73468 10.2478 5.38701 9.17462 4.73245 10.8312 numMergedOcc 0
12 mol 148 unq 1 iso 0 dist 9.91993 5.99954 9.99156 10.2478 8.73468 6.84291 11.5545 8.74878 6.77599 4.43652 numMergedOcc 0
13 mol 148 unq 1 iso 1 dist 9.99156 5.99954 9.91993 6.84291 8.73468 10.2478 6.77599 8.74878 11.5545 4.43652 numMergedOcc 0
14 mol 148 unq 2 iso 0 dist 6.22055 5.99954 8.18085 10.2478 9.73927 6.84291 4.73245 5.75959 5.38701 10.8312 numMergedOcc 0
15 mol 148 unq 2 iso 1 dist 8.18085 5.99954 6.22055 6.84291 9.73927 10.2478 5.38701 5.75959 4.73245 10.8312 numMergedOcc 0
16 mol 150 unq 0 iso 0 dist 9.96691 5.93095 9.8656 10.2318 8.73558 6.79619 4.73768 9.01668 5.46333 10.8596 numMergedOcc 0
17 mol 150 unq 0 iso 1 dist 9.8656 5.93095 9.96691 6.79619 8.73558 10.2318 5.46333 9.01668 4.73768 10.8596 numMergedOcc 0
18 mol 150 unq 1 iso 0 dist 9.96691 5.93095 9.8656 10.2318 8.73558 6.79619 11.5728 8.74018 6.74495 4.48089 numMergedOcc 0
19 mol 150 unq 1 iso 1 dist 9.8656 5.93095 9.96691 6.79619 8.73558 10.2318 6.74495 8.74018 11.5728 4.48089 numMergedOcc 0
20 mol 150 unq 2 iso 0 dist 6.14675 5.93095 7.94889 10.2318 9.66129 6.79619 4.73768 5.4798 5.46333 10.8596 numMergedOcc 0
21 mol 150 unq 2 iso 1 dist 7.94889 5.93095 6.14675 6.79619 9.66129 10.2318 5.46333 5.4798 4.73768 10.8596 numMergedOcc 0
22 mol 232 unq 0 iso 0 dist 8.50102 6.56633 9.40808 8.78722 7.17337 13.5597 6.95968 9.78273 4.04428 12.899 numMergedOcc 0
23 mol 232 unq 0 iso 1 dist 9.40808 6.56633 8.50102 13.5597 7.17337 8.78722 4.04428 9.78273 6.95968 12.899 numMergedOcc 0
24 mol 273 unq 0 iso 0 dist 8.83865 5.96724 9.18157 4.89568 8.68913 5.14347 9.32873 9.81919 5.04315 9.83412 numMergedOcc 0
25 mol 273 unq 0 iso 1 dist 9.18157 5.96724 8.83865 5.14347 8.68913 4.89568 5.04315 9.81919 9.32873 9.83412 numMergedOcc 0
26 mol 287 unq 0 iso 0 dist 8.91712 10.9208 9.65934 4.62998 5.59555 7.23534 13.2948 9.25759 3.65199 8.99193 numMergedOcc 0
27 mol 287 unq 0 iso 1 dist 9.65934 10.9208 8.91712 7.23534 5.59555 4.62998 3.65199 9.25759 13.2948 8.99193 numMergedOcc 0
28 mol 288 unq 0 iso 0 dist 8.91712 10.9208 9.65934 4.62998 5.59555 7.23534 13.2948 9.25759 3.65199 8.99193 numMergedOcc 0
29 mol 288 unq 0 iso 1 dist 9.65934 10.9208 8.91712 7.23534 5.59555 4.62998 3.65199 9.25759 13.2948 8.99193 numMergedOcc 0
30 mol 289 unq 0 iso 0 dist 8.91712 10.9208 9.65934 4.62998 5.59555 7.23534 13.2948 9.25759 3.65199 8.99193 numMergedOcc 0
31 mol 289 unq 0 iso 1 dist 9.65934 10.9208 8.91712 7.23534 5.59555 4.62998 3.65199 9.25759 13.2948 8.99193 numMergedOcc 0
